data_2mbm_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2mbm _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.44 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt . . . . . 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.435 HG13 HD11 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.428 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.428 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 . . . . . 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 . . . . . 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.437 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.474 HD11 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.457 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD11 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.435 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.435 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 . . . . . 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.92 0.391 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.493 HD12 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.474 ' HB3' ' HZ1' ' A' ' 34' ' ' LYS . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HB3' HD23 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 . . . . . 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.44 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.44 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.405 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.408 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.447 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 . . . . . 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt . . . . . 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.483 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 . . . . . 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt . . . . . 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt . . . . . 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.449 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG21 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 16' ' ' GLY . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' A' ' 15' ' ' ASN . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.487 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.487 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.402 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.409 ' O ' HG21 ' A' ' 84' ' ' VAL . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG22 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.402 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.431 HG22 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.406 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 . . . . . 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.436 HD11 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.425 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.425 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 . . . . . 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 5' ' ' LYS . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.421 ' HB3' ' H ' ' A' ' 16' ' ' GLY . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.421 ' H ' ' HB3' ' A' ' 15' ' ' ASN . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt . . . . . 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.4 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.478 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.466 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.466 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt . . . . . 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.435 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.412 ' CE1' ' HB2' ' A' ' 5' ' ' LYS . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.46 ' HB2' HD22 ' A' ' 33' ' ' LEU . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.433 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.432 HD12 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.413 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.522 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.413 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.522 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 . . . . . 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.512 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 29.2 t -68.52 161.79 27.09 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.076 0.95 . . . . 0.0 108.478 -162.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.63 -158.12 32.31 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -175.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.51 155.61 35.1 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.601 0.76 . . . . 0.0 111.362 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -94.99 140.92 29.27 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.512 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.44 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -123.57 145.86 48.58 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.7 mt -109.79 145.53 36.53 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.827 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.13 57.48 3.17 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 125.301 1.44 . . . . 0.0 110.485 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -108.9 -78.12 1.04 Allowed Glycine 0 N--CA 1.472 1.035 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.993 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 74.4 t -70.07 -48.08 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -94.52 100.88 12.78 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.539 -1.209 . . . . 0.0 108.678 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -88.85 -3.16 58.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.667 0.787 . . . . 0.0 111.654 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.57 73.1 10.52 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.661 0.743 . . . . 0.0 110.72 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.61 135.28 57.71 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -73.73 99.98 3.29 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 123.717 0.636 . . . . 0.0 111.086 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -87.51 149.93 24.06 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.64 -1.164 . . . . 0.0 108.26 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -64.96 140.03 58.82 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -55.04 132.38 47.05 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.294 0.997 . . . . 0.0 112.297 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 C--O 1.249 1.05 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.91 -179.249 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.476 0.839 0 CA-C-O 121.665 0.745 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.8 t -151.22 54.38 0.86 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 169.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 116.78 -163.57 12.47 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -120.98 157.51 29.78 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.327 0.651 . . . . 0.0 109.719 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -102.15 129.06 48.42 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.435 HD11 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.435 HG13 HD11 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.428 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.428 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -118.1 131.77 56.41 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -98.52 136.44 38.63 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -54.98 93.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.475 0.71 . . . . 0.0 111.23 178.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.04 34.93 0.1 Allowed Glycine 0 C--N 1.339 0.738 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.696 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.07 88.2 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 123.689 0.795 . . . . 0.0 110.715 -170.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -175.03 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.319 -1.31 . . . . 0.0 108.09 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.5 mt -89.39 72.51 8.01 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.456 173.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.91 155.98 38.13 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.847 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -74.83 85.03 2.19 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.771 0.828 . . . . 0.0 111.046 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -88.12 5.39 41.51 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.79 0.436 . . . . 0.0 110.346 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.61 68.99 10.04 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -154.75 164.92 38.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.777 1.231 . . . . 0.0 108.422 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -67.75 130.12 42.01 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.915 0.486 . . . . 0.0 110.979 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.8 t60 . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.439 1.095 . . . . 0.0 108.268 179.811 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.422 ' O ' ' N ' ' A' ' 3' ' ' GLY . 62.4 ttp . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -66.64 72.84 0.09 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.15 0.58 . . . . 0.0 110.049 -167.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 1' ' ' MET . . . 84.45 77.26 1.16 Allowed Glycine 0 C--N 1.338 0.655 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -134.71 134.93 41.59 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.548 -0.826 . . . . 0.0 110.783 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -105.73 132.51 51.77 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 172.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -124.14 151.77 43.59 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.8 mt -64.12 129.3 39.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.653 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 49.99 36.09 11.09 Favored 'General case' 0 CA--C 1.559 1.305 0 O-C-N 124.297 0.998 . . . . 0.0 110.583 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.32 -44.79 94.92 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.513 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 84.3 t -124.96 -75.03 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -179.43 125.17 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.366 1.866 . . . . 0.0 107.165 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.48 -67.25 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -169.97 -179.98 3.4 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.584 -1.643 . . . . 0.0 106.936 175.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.5 t-80 -80.13 132.44 35.93 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.632 0.373 . . . . 0.0 110.52 174.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -64.31 117.88 7.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.402 0.681 . . . . 0.0 110.822 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -100.11 163.69 12.31 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -54.85 -40.65 69.87 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.877 0.871 . . . . 0.0 112.57 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -151.98 167.89 26.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.398 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.247 0.93 0 C-N-CA 123.765 0.826 . . . . 0.0 108.931 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mmm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.692 0.282 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.1 m -73.36 -40.83 64.09 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.664 0.786 . . . . 0.0 110.353 -165.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.8 -163.6 10.14 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.444 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -146.99 139.63 24.95 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 163.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -116.25 134.04 55.35 Favored 'General case' 0 C--N 1.351 0.664 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 -176.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.437 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.474 HD11 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.457 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 32' ' ' GLU . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD11 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.435 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.435 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -93.82 146.02 24.18 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 tp -133.29 144.64 49.83 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.762 0.825 . . . . 0.0 110.173 -174.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -69.79 172.14 8.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-O 122.275 1.036 . . . . 0.0 112.286 169.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.6 -154.6 24.32 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.418 175.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.18 171.56 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.281 1.032 . . . . 0.0 110.574 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 75.01 -16.7 0.55 Allowed 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 125.672 1.589 . . . . 0.0 114.394 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.67 150.72 31.22 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.243 1.017 . . . . 0.0 111.216 -168.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -65.08 -41.07 95.38 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -83.21 175.02 10.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.336 0.654 . . . . 0.0 111.61 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -57.76 132.09 52.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 123.892 0.745 . . . . 0.0 111.463 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -153.81 175.53 13.2 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.944 0.898 . . . . 0.0 109.994 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -119.9 170.78 8.94 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.411 1.084 . . . . 0.0 108.25 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.32 70.1 10.79 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.8 t-80 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.051 1.34 . . . . 0.0 110.07 178.461 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.5 t -128.87 103.86 7.28 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.41 -173.73 13.1 Favored Glycine 0 C--N 1.354 1.558 0 C-N-CA 122.774 0.226 . . . . 0.0 112.803 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -116.57 150.01 38.71 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.583 0.753 . . . . 0.0 110.229 173.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -107.22 130.71 54.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.517 0.727 . . . . 0.0 110.641 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.493 HD12 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.422 HD23 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.474 ' HB3' ' HZ1' ' A' ' 34' ' ' LYS . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HB3' HD23 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.516 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -101.37 148.6 24.96 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.5 mt -59.38 133.95 56.57 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 123.661 0.601 . . . . 0.0 110.051 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -76.33 -29.9 57.45 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.412 1.085 . . . . 0.0 110.673 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.44 165.61 13.11 Favored Glycine 0 C--N 1.341 0.818 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 78.6 t -67.93 -39.66 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -143.7 144.38 31.83 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.073 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.7 mt -103.68 176.22 5.22 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 -172.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -41.14 -44.1 2.45 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.391 0.676 . . . . 0.0 109.792 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -82.95 71.91 10.05 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -64.82 99.61 0.35 Allowed 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.003 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -137.32 44.66 2.25 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.397 1.079 . . . . 0.0 109.511 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -55.77 138.1 48.52 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.137 0.575 . . . . 0.0 110.684 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -67.11 -22.14 65.82 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -170.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.248 0.982 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.261 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mmm . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.378 0.132 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.7 p -133.27 20.88 4.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.339 0.656 . . . . 0.0 110.012 -178.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 110.61 114.99 3.58 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -131.07 130.65 43.49 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.699 0.799 . . . . 0.0 110.735 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -108.34 126.08 52.45 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.44 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.44 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' CA ' HG13 ' A' ' 111' ' ' VAL . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.405 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -76.34 140.72 41.57 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.26 122.45 20.27 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -89.43 109.41 20.33 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 172.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 117.81 31.89 1.53 Allowed Glycine 0 C--N 1.338 0.687 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.22 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.407 HG13 ' CA ' ' A' ' 52' ' ' GLY . 74.6 t -61.99 110.11 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 48.51 54.4 10.56 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 124.781 1.232 . . . . 0.0 112.071 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.0 mt -97.87 165.52 11.89 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.999 0.519 . . . . 0.0 110.109 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -56.85 144.07 34.73 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.546 0.738 . . . . 0.0 110.873 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 74.86 12.17 3.61 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.502 1.521 . . . . 0.0 113.834 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -99.25 -28.57 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -99.97 81.94 2.5 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -79.32 140.02 37.64 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.428 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -124.98 29.0 6.26 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.696 0.798 . . . . 0.0 110.056 -178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 124.333 1.053 . . . . 0.0 109.787 -176.524 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.92 0.39 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.7 t -84.08 106.91 16.1 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 109.907 168.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.93 79.66 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.59 158.58 43.64 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 123.53 0.732 . . . . 0.0 110.546 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -94.79 132.89 39.08 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.408 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.447 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -114.4 139.46 49.47 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 55.1 mt -83.82 148.69 26.86 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.487 0.661 . . . . 0.0 111.925 -172.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.94 -43.26 68.54 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.053 173.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.47 -173.96 50.85 Favored Glycine 0 C--N 1.357 1.736 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.655 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t 81.33 -55.0 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 126.002 1.721 . . . . 0.0 112.478 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -53.42 111.15 0.65 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.363 1.865 . . . . 0.0 112.33 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.7 mt -107.02 150.79 26.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.766 1.226 . . . . 0.0 108.534 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -85.13 145.28 27.71 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -111.64 24.85 12.27 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -84.99 146.2 27.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.434 0.694 . . . . 0.0 110.008 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.7 39.83 3.31 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -72.28 -19.39 61.69 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.329 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.61 135.94 57.64 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.934 0.894 . . . . 0.0 110.462 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 . . . . . 0 C--O 1.246 0.908 0 C-N-CA 124.581 1.152 . . . . 0.0 108.934 -179.633 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.449 ' H ' HG21 ' A' ' 28' ' ' VAL . 99.8 p -150.74 7.27 0.55 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.46 0.704 . . . . 0.0 110.968 162.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.67 -89.65 1.49 Allowed Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 -167.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -122.78 165.11 17.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.747 0.819 . . . . 0.0 111.497 -168.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -120.91 140.08 52.32 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -176.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.449 HG21 ' H ' ' A' ' 2' ' ' SER . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.451 ' HA ' HD22 ' A' ' 108' ' ' LEU . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -76.26 134.14 39.88 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 49' ' ' LYS . 55.1 tp -81.27 127.53 32.81 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 58.33 20.95 7.76 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.675 1.19 . . . . 0.0 111.687 -174.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.56 64.0 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 -178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -105.84 -0.54 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 123.187 0.595 . . . . 0.0 111.522 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -155.39 67.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.931 0.893 . . . . 0.0 108.644 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.56 -37.95 22.32 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.003 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -80.0 110.42 15.37 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.346 0.658 . . . . 0.0 112.637 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -114.77 -10.48 12.4 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.914 0.886 . . . . 0.0 110.676 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -85.0 -65.0 1.06 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -87.51 64.79 8.31 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -144.16 89.93 2.07 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.124 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -125.02 44.98 2.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.139 0.975 . . . . 0.0 109.666 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 . . . . . 0 C--O 1.254 1.295 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.426 ' O ' ' C ' ' A' ' 2' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.426 ' C ' ' O ' ' A' ' 1' ' ' MET . 70.5 m -40.19 128.94 2.3 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 -163.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.17 -151.22 27.95 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -102.15 153.43 19.95 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 123.6 0.76 . . . . 0.0 110.604 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -83.1 130.33 35.11 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.483 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -112.45 132.7 54.92 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 86.7 mt -121.85 155.08 36.13 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.035 0.445 . . . . 0.0 110.569 -175.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.53 -29.78 70.45 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.554 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 61.97 -148.96 47.66 Favored Glycine 0 C--N 1.355 1.607 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.836 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.571 HG21 ' O ' ' A' ' 111' ' ' VAL . 29.8 m -90.91 68.27 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 57.13 45.45 20.7 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 124.525 1.13 . . . . 0.0 111.435 -174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.0 mt -100.65 155.9 17.62 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.232 0.613 . . . . 0.0 110.043 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -127.23 113.56 16.49 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.148 0.579 . . . . 0.0 109.813 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -79.58 95.33 5.84 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.642 0.777 . . . . 0.0 109.739 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -103.48 144.94 30.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.199 1.0 . . . . 0.0 109.729 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -144.96 110.85 5.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.809 0.844 . . . . 0.0 108.763 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -89.98 145.34 25.18 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -144.74 -2.71 0.82 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.943 0.897 . . . . 0.0 110.862 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 CA--C 1.556 1.204 0 C-N-CA 122.832 0.453 . . . . 0.0 110.37 -179.197 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.465 ' HG2' ' HG2' ' A' ' 29' ' ' ARG . 65.6 mtm . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -137.57 113.99 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.996 0.918 . . . . 0.0 110.157 172.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.31 103.82 0.73 Allowed Glycine 0 C--N 1.354 1.571 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.369 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -120.19 154.33 34.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.156 0.582 . . . . 0.0 109.764 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -103.55 129.96 50.86 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.465 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -143.65 158.14 43.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.55 164.77 11.79 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.798 0.839 . . . . 0.0 109.438 -178.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -94.76 112.53 24.26 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.9 76.21 0.29 Allowed Glycine 0 C--N 1.334 0.464 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -175.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.72 -47.63 90.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.852 0.358 . . . . 0.0 110.415 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -103.75 102.96 12.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 173.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.21 -40.03 11.77 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -153.49 139.86 18.62 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.224 1.41 . . . . 0.0 108.431 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.3 t-80 -64.66 150.41 47.18 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -84.96 10.98 10.32 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.122 0.963 . . . . 0.0 110.017 -168.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -59.53 -24.01 63.32 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 124.486 1.115 . . . . 0.0 111.268 176.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 64.0 t-80 -72.82 116.0 12.79 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.819 0.818 . . . . 0.0 111.106 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -129.78 -36.73 1.58 Allowed 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.253 1.286 0 CA-C-N 113.944 -1.48 . . . . 0.0 107.474 179.762 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HB3' ' CE1' ' A' ' 26' ' ' TYR . 77.3 mtm . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -132.64 149.55 52.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 156.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.97 -166.6 14.65 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 168.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -100.26 147.04 26.2 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.755 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -90.15 132.47 35.43 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.449 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 1' ' ' MET . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.427 ' HE1' HD12 ' A' ' 108' ' ' LEU . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 108' ' ' LEU . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG21 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -116.72 145.58 43.37 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.472 HD21 ' C ' ' A' ' 108' ' ' LEU . 7.4 tt -139.28 135.09 33.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.847 1.259 . . . . 0.0 107.727 -173.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.9 111.54 23.83 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.993 0.425 . . . . 0.0 111.626 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -123.36 75.04 0.38 Allowed Glycine 0 C--N 1.342 0.867 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -74.9 -46.25 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.46 1.104 . . . . 0.0 111.592 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -119.37 100.48 7.33 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.96 140.97 29.14 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.115 0.566 . . . . 0.0 109.916 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -91.54 150.83 21.02 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.796 175.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -133.74 71.28 1.46 Allowed 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 121.76 0.791 . . . . 0.0 109.853 -175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -61.49 139.95 58.15 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -63.35 67.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 125.49 1.516 . . . . 0.0 114.803 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m170 -111.57 154.86 24.21 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.18 1.792 . . . . 0.0 107.904 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -135.06 65.37 1.56 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.8 0.81 . . . . 0.0 110.053 -178.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 . . . . . 0 N--CA 1.484 1.228 0 C-N-CA 123.854 0.862 . . . . 0.0 109.329 -178.221 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.401 ' H3 ' ' HA ' ' A' ' 27' ' ' ALA . 99.2 mmm . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -82.93 -137.3 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.821 0.819 . . . . 0.0 109.802 169.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.16 -120.29 10.33 Favored Glycine 0 C--N 1.341 0.843 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.387 174.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -116.9 145.35 43.65 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.269 0.627 . . . . 0.0 110.647 -172.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -107.29 136.23 47.46 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -173.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.401 ' HA ' ' H3 ' ' A' ' 1' ' ' MET . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.415 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -136.08 129.83 32.49 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.5 mt -130.13 156.39 44.63 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 124.009 0.924 . . . . 0.0 109.345 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -78.75 67.78 4.57 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -67.42 141.61 39.28 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.92 -177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 93.4 t -127.28 118.72 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -73.1 103.77 3.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.806 0.691 . . . . 0.0 109.796 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.9 mt -94.83 -0.94 53.68 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.358 0.663 . . . . 0.0 110.544 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -85.4 105.1 15.79 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.238 0.542 . . . . 0.0 109.961 -175.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -85.48 143.8 28.33 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.114 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 57.58 41.0 26.39 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.218 1.007 . . . . 0.0 108.468 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -72.02 -9.08 57.88 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.473 -1.239 . . . . 0.0 113.003 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -91.52 -9.35 44.71 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.579 0.352 . . . . 0.0 111.324 172.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -102.78 145.96 28.96 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 0.0 109.734 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 . . . . . 0 CA--C 1.556 1.196 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.82 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HB2' ' CE2' ' A' ' 26' ' ' TYR . 94.4 mmm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.7 m -149.48 4.8 0.6 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.989 0.916 . . . . 0.0 112.101 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.66 -139.71 10.61 Favored Glycine 0 C--N 1.348 1.21 0 O-C-N 123.308 0.38 . . . . 0.0 113.423 -161.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.28 158.61 36.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.903 0.881 . . . . 0.0 108.72 -173.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -103.8 130.85 51.39 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 16' ' ' GLY . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' A' ' 15' ' ' ASN . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 1' ' ' MET . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -147.46 120.2 8.64 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.477 HD22 ' O ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -90.11 158.74 17.14 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 123.651 0.78 . . . . 0.0 111.283 -174.487 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.75 145.93 24.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.276 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 110.61 -36.37 4.29 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.6 t -101.5 -52.91 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.663 0.785 . . . . 0.0 110.611 170.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -109.84 76.18 0.98 Allowed 'General case' 0 C--O 1.24 0.571 0 C-N-CA 123.795 0.838 . . . . 0.0 109.069 168.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 tp -65.0 128.06 34.19 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.719 -167.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 53.73 45.22 28.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.824 1.25 . . . . 0.0 112.801 175.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -73.17 -54.78 7.6 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -91.04 70.05 6.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -79.47 5.76 12.02 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.565 1.146 . . . . 0.0 113.292 -178.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -153.38 165.18 36.58 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 109.469 -178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -70.76 134.03 47.07 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.529 0.732 . . . . 0.0 110.062 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.8 m80 . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.631 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.435 ' HE1' HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.233 0.54 . . . . 0.0 111.077 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 4' ' ' LYS . 30.6 t -79.22 -149.61 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.09 65.23 1.25 Allowed Glycine 0 C--N 1.337 0.6 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -165.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' N ' ' O ' ' A' ' 2' ' ' SER . 99.2 mttt -139.71 147.55 41.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.329 0.652 . . . . 0.0 110.753 167.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.3 121.89 22.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.169 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.487 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.487 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HA ' HD22 ' A' ' 108' ' ' LEU . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.402 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.435 HD12 ' HE1' ' A' ' 1' ' ' MET . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG22 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.402 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.431 HG22 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -89.36 140.3 29.64 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.56 HD22 ' HA ' ' A' ' 49' ' ' LYS . 63.8 tp -75.54 139.48 42.17 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 175.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 108' ' ' LEU . 96.6 mt-10 78.06 -37.36 0.23 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.423 1.889 . . . . 0.0 109.649 -178.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -60.02 -40.59 97.22 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 171.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.05 94.96 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 173.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -160.3 122.41 3.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.013 0.925 . . . . 0.0 108.933 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.8 mt -115.72 172.05 7.37 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 168.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -75.64 64.61 1.71 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.468 1.107 . . . . 0.0 111.969 -176.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.17 65.7 1.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.151 1.381 . . . . 0.0 108.159 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -81.65 103.45 11.36 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.34 1.067 . . . . 0.0 108.709 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -100.48 -36.25 9.26 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.908 -174.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -72.34 106.56 4.53 Favored 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 124.409 1.084 . . . . 0.0 110.002 -178.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -136.05 44.36 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.25 1.02 . . . . 0.0 109.322 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.25 1.079 0 C-N-CA 123.727 0.811 . . . . 0.0 109.558 -177.38 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mmm . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 t -167.23 31.03 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.582 0.753 . . . . 0.0 111.055 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.78 -111.92 3.46 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.556 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -109.76 149.72 29.38 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.982 0.913 . . . . 0.0 110.366 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.04 140.04 50.33 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -174.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.406 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.406 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -92.92 154.1 18.39 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -67.23 131.03 44.96 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.809 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -52.78 -42.38 64.98 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.968 0.907 . . . . 0.0 111.769 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 169.29 163.25 23.0 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.143 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.7 t -97.93 130.37 46.78 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.7 t0 54.71 61.95 2.75 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 125.061 1.345 . . . . 0.0 110.064 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.28 139.53 38.87 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.347 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -90.39 -22.45 21.47 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.042 0.937 . . . . 0.0 109.275 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.11 69.92 10.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -141.6 -5.98 1.03 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 177.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -86.59 65.0 8.82 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -165.76 175.51 8.71 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 108.286 -177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -61.23 136.55 58.09 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.469 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mmm . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 99.0 p -47.05 141.12 4.42 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.27 -155.29 31.83 Favored Glycine 0 C--N 1.334 0.455 0 N-CA-C 108.986 -1.645 . . . . 0.0 108.986 -168.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -95.91 163.19 13.26 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.512 0.725 . . . . 0.0 111.417 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -91.64 133.02 35.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.499 0.72 . . . . 0.0 109.065 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.436 HD11 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.43 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HA ' HD13 ' A' ' 108' ' ' LEU . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.425 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.425 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -150.59 136.41 18.27 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 49' ' ' LYS . 68.4 mt -128.58 138.36 52.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.52 0.728 . . . . 0.0 109.672 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -82.69 -62.23 1.66 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.766 0.826 . . . . 0.0 108.794 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 166.46 111.56 0.25 Allowed Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.045 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.409 ' HB ' ' HB3' ' A' ' 49' ' ' LYS . 95.5 t -98.9 128.47 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 122.973 0.509 . . . . 0.0 110.846 -176.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -77.94 79.81 4.4 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.031 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.35 83.13 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -56.86 -40.75 76.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.105 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.97 133.93 7.3 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.032 1.333 . . . . 0.0 107.94 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -95.48 138.75 32.73 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -118.8 165.94 13.41 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.146 0.578 . . . . 0.0 109.879 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -55.28 125.06 19.13 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.968 0.907 . . . . 0.0 110.069 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -78.33 122.86 26.3 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.925 0.766 . . . . 0.0 110.097 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HB3' ' HB2' ' A' ' 26' ' ' TYR . 58.8 mtt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p -140.07 16.67 2.45 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.778 1.231 . . . . 0.0 111.043 157.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.2 -129.78 6.38 Favored Glycine 0 C--N 1.343 0.938 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -167.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -113.77 148.58 36.27 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 123.505 0.722 . . . . 0.0 110.129 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt -98.9 124.36 43.78 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.201 -163.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.411 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 5' ' ' LYS . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.411 ' HE2' ' HG2' ' A' ' 1' ' ' MET . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -140.28 153.4 46.48 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.7 mt -123.56 144.8 49.34 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.454 176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -90.7 -19.68 23.31 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.597 0.759 . . . . 0.0 109.383 176.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 86.17 -60.3 4.6 Favored Glycine 0 C--N 1.342 0.88 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.746 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.5 m -87.09 160.05 3.02 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 123.557 0.743 . . . . 0.0 109.976 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -68.03 146.37 53.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.713 0.405 . . . . 0.0 110.546 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.27 -20.91 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.056 0.942 . . . . 0.0 113.372 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -90.13 -152.89 0.27 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 118.118 0.417 . . . . 0.0 110.498 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -69.67 72.69 0.37 Allowed 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -52.7 130.0 31.26 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.135 0.493 . . . . 0.0 111.81 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -91.02 135.02 34.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -80.85 93.61 6.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -80.8 144.91 31.73 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.244 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 -177.352 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.583 ' O ' ' HB2' ' A' ' 2' ' ' SER . 99.2 mmm . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.823 0.345 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.583 ' HB2' ' O ' ' A' ' 1' ' ' MET . 31.9 t 170.5 166.19 0.07 Allowed 'General case' 0 C--O 1.244 0.801 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.755 164.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -86.02 -80.14 1.16 Allowed Glycine 0 C--N 1.344 1.027 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 156.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -96.57 152.14 18.92 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.008 0.523 . . . . 0.0 110.993 178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -99.71 141.95 31.84 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.421 ' HB3' ' H ' ' A' ' 16' ' ' GLY . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.421 ' H ' ' HB3' ' A' ' 15' ' ' ASN . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 2' ' ' SER . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.438 ' N ' ' HB2' ' A' ' 2' ' ' SER . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HA ' HD12 ' A' ' 108' ' ' LEU . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.445 ' HB2' ' HG ' ' A' ' 108' ' ' LEU . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -85.31 137.47 32.94 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.445 ' HG ' ' HB2' ' A' ' 53' ' ' CYS . 2.7 tm? -71.54 129.99 40.12 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.962 0.905 . . . . 0.0 109.767 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 74.88 -67.14 0.26 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.793 1.237 . . . . 0.0 109.684 177.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.79 66.39 3.75 Favored Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 176.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.3 t -72.61 81.8 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-O 121.923 0.868 . . . . 0.0 111.798 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -170.76 157.75 5.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.79 1.236 . . . . 0.0 108.706 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.6 mt -105.94 -26.97 11.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.598 0.759 . . . . 0.0 110.008 173.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -94.85 77.32 3.63 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.618 0.767 . . . . 0.0 111.669 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.96 70.38 10.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.592 0.757 . . . . 0.0 109.705 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -76.56 135.24 39.26 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.117 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -138.06 65.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.109 0.963 . . . . 0.0 108.554 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -96.44 129.11 43.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.616 0.766 . . . . 0.0 109.852 -178.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -59.61 121.32 11.3 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.9 m170 . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 124.317 1.047 . . . . 0.0 109.541 -179.793 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mtp . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.79 0.805 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.9 t -110.68 -65.01 1.2 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.088 -172.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.94 115.03 0.39 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -136.35 144.34 44.56 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.274 0.559 . . . . 0.0 111.002 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -106.73 121.56 44.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.4 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.478 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.466 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.466 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -139.79 141.07 36.78 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.2 tp -72.66 123.53 23.44 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.934 0.894 . . . . 0.0 108.815 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 62.01 9.99 3.38 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 126.114 1.765 . . . . 0.0 114.445 -166.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -91.05 -33.47 8.18 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 170.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -78.06 -155.03 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.341 0 C-N-CA 125.1 1.36 . . . . 0.0 110.241 171.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -57.63 116.57 3.48 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.27 0.628 . . . . 0.0 111.354 178.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.05 145.42 54.47 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.776 0.831 . . . . 0.0 109.388 -176.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -111.48 165.89 11.6 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.03 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -68.06 -23.29 64.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.5 0.72 . . . . 0.0 110.59 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 64.3 t-80 -100.42 131.3 46.42 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -75.11 117.61 17.13 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 124.053 0.845 . . . . 0.0 111.473 176.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -110.45 172.05 7.09 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -177.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -58.85 138.13 57.44 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 118.393 0.542 . . . . 0.0 111.104 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 125.147 1.379 . . . . 0.0 108.445 179.341 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.406 ' HA ' ' O ' ' A' ' 26' ' ' TYR . 74.7 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 119.977 -0.059 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.6 ' HB3' ' HA ' ' A' ' 27' ' ' ALA . 39.8 t -166.72 -95.94 0.01 OUTLIER 'General case' 0 C--O 1.246 0.898 0 C-N-CA 123.469 0.708 . . . . 0.0 110.695 -165.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.474 ' O ' ' CD2' ' A' ' 26' ' ' TYR . . . -119.84 -133.9 4.67 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -42.33 143.04 0.68 Allowed 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.536 1.134 . . . . 0.0 110.199 -156.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt -98.88 135.29 40.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -166.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.435 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.435 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 2' ' ' SER . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.6 ' HA ' ' HB3' ' A' ' 2' ' ' SER . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB2' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.433 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.442 ' HE1' HD23 ' A' ' 108' ' ' LEU . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 112' ' ' ASP . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.432 HD12 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.413 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.522 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.413 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.522 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -84.82 134.94 34.29 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.442 HD23 ' HE1' ' A' ' 45' ' ' MET . 35.8 tp -105.42 122.87 46.88 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 48.21 -70.51 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 126.514 1.926 . . . . 0.0 114.161 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 134.16 6.85 2.37 Favored Glycine 0 C--N 1.344 1.004 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 -173.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.4 t -79.02 131.19 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 122.225 1.012 . . . . 0.0 111.937 167.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.419 ' HB2' ' HB2' ' A' ' 54' ' ' LYS . 68.4 t0 -138.39 98.18 3.54 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.326 -1.306 . . . . 0.0 107.928 -176.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -87.67 86.71 7.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.163 0.985 . . . . 0.0 109.813 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -76.84 -36.65 56.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.023 0.929 . . . . 0.0 112.288 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -128.66 -35.47 1.91 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.254 0.621 . . . . 0.0 109.824 -176.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -85.45 66.05 9.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.52 0.728 . . . . 0.0 110.023 178.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -74.91 139.95 43.44 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.606 1.162 . . . . 0.0 112.876 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -64.58 135.31 55.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.366 0.667 . . . . 0.0 110.407 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 34.0 p80 -66.81 166.43 13.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.945 0.898 . . . . 0.0 110.551 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 122.882 0.473 . . . . 0.0 110.562 179.768 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.451 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt . . . . . 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.443 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.443 HG13 HD13 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.43 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.43 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 . . . . . 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 . . . . . 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.456 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 . . . . . 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.92 0.391 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 . . . . . 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.444 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.53 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 . . . . . 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt . . . . . 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.442 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.489 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.489 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 . . . . . 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt . . . . . 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 48' ' ' ILE . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.403 ' HA ' ' CG1' ' A' ' 48' ' ' ILE . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.403 ' CG1' ' HA ' ' A' ' 45' ' ' MET . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt . . . . . 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.455 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 48' ' ' ILE . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.486 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.431 HG21 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.424 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 36' ' ' LYS . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.436 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB3' HD22 ' A' ' 25' ' ' LEU . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 51' ' ' LEU . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 . . . . . 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.427 HD13 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 . . . . . 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.47 ' CZ ' ' HB2' ' A' ' 5' ' ' LYS . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt . . . . . 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.477 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.472 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.472 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt . . . . . 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 5' ' ' LYS . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.467 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 58' ' ' ILE . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.411 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.53 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.53 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 . . . . . 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 29.2 t -68.52 161.79 27.09 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.076 0.95 . . . . 0.0 108.478 -162.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.63 -158.12 32.31 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -175.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.51 155.61 35.1 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.601 0.76 . . . . 0.0 111.362 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -94.99 140.92 29.27 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.545 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.451 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -123.57 145.86 48.58 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.7 mt -109.79 145.53 36.53 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.827 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.13 57.48 3.17 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 125.301 1.44 . . . . 0.0 110.485 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -108.9 -78.12 1.04 Allowed Glycine 0 N--CA 1.472 1.035 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.993 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 74.4 t -70.07 -48.08 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -94.52 100.88 12.78 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.539 -1.209 . . . . 0.0 108.678 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -88.85 -3.16 58.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.667 0.787 . . . . 0.0 111.654 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.57 73.1 10.52 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.661 0.743 . . . . 0.0 110.72 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.61 135.28 57.71 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -73.73 99.98 3.29 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 123.717 0.636 . . . . 0.0 111.086 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -87.51 149.93 24.06 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.64 -1.164 . . . . 0.0 108.26 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -64.96 140.03 58.82 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -55.04 132.38 47.05 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.294 0.997 . . . . 0.0 112.297 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 C--O 1.249 1.05 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.91 -179.249 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.476 0.839 0 CA-C-O 121.665 0.745 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.8 t -151.22 54.38 0.86 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 169.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 116.78 -163.57 12.47 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -120.98 157.51 29.78 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.327 0.651 . . . . 0.0 109.719 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -102.15 129.06 48.42 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.443 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.443 HG13 HD13 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.43 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.43 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -118.1 131.77 56.41 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -98.52 136.44 38.63 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -54.98 93.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.475 0.71 . . . . 0.0 111.23 178.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.04 34.93 0.1 Allowed Glycine 0 C--N 1.339 0.738 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.696 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.07 88.2 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 123.689 0.795 . . . . 0.0 110.715 -170.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -175.03 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.319 -1.31 . . . . 0.0 108.09 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.5 mt -89.39 72.51 8.01 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.456 173.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.91 155.98 38.13 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.847 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -74.83 85.03 2.19 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.771 0.828 . . . . 0.0 111.046 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -88.12 5.39 41.51 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.79 0.436 . . . . 0.0 110.346 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.61 68.99 10.04 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -154.75 164.92 38.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.777 1.231 . . . . 0.0 108.422 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -67.75 130.12 42.01 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.915 0.486 . . . . 0.0 110.979 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.8 t60 . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.439 1.095 . . . . 0.0 108.268 179.811 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' N ' ' A' ' 3' ' ' GLY . 62.4 ttp . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -66.64 72.84 0.09 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.15 0.58 . . . . 0.0 110.049 -167.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 1' ' ' MET . . . 84.45 77.26 1.16 Allowed Glycine 0 C--N 1.338 0.655 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -134.71 134.93 41.59 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.548 -0.826 . . . . 0.0 110.783 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -105.73 132.51 51.77 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 172.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -124.14 151.77 43.59 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.8 mt -64.12 129.3 39.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.653 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 49.99 36.09 11.09 Favored 'General case' 0 CA--C 1.559 1.305 0 O-C-N 124.297 0.998 . . . . 0.0 110.583 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.32 -44.79 94.92 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.513 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 84.3 t -124.96 -75.03 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -179.43 125.17 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.366 1.866 . . . . 0.0 107.165 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.48 -67.25 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -169.97 -179.98 3.4 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.584 -1.643 . . . . 0.0 106.936 175.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.5 t-80 -80.13 132.44 35.93 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.632 0.373 . . . . 0.0 110.52 174.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -64.31 117.88 7.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.402 0.681 . . . . 0.0 110.822 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -100.11 163.69 12.31 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -54.85 -40.65 69.87 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.877 0.871 . . . . 0.0 112.57 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -151.98 167.89 26.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.398 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.247 0.93 0 C-N-CA 123.765 0.826 . . . . 0.0 108.931 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mmm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.692 0.282 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.1 m -73.36 -40.83 64.09 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.664 0.786 . . . . 0.0 110.353 -165.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.8 -163.6 10.14 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.444 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -146.99 139.63 24.95 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 163.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -116.25 134.04 55.35 Favored 'General case' 0 C--N 1.351 0.664 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 -176.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.456 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -93.82 146.02 24.18 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 tp -133.29 144.64 49.83 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.762 0.825 . . . . 0.0 110.173 -174.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -69.79 172.14 8.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-O 122.275 1.036 . . . . 0.0 112.286 169.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.6 -154.6 24.32 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.418 175.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.18 171.56 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.281 1.032 . . . . 0.0 110.574 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 75.01 -16.7 0.55 Allowed 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 125.672 1.589 . . . . 0.0 114.394 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.67 150.72 31.22 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.243 1.017 . . . . 0.0 111.216 -168.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -65.08 -41.07 95.38 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -83.21 175.02 10.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.336 0.654 . . . . 0.0 111.61 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -57.76 132.09 52.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 123.892 0.745 . . . . 0.0 111.463 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -153.81 175.53 13.2 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.944 0.898 . . . . 0.0 109.994 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -119.9 170.78 8.94 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.411 1.084 . . . . 0.0 108.25 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.32 70.1 10.79 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.8 t-80 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.051 1.34 . . . . 0.0 110.07 178.461 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.5 t -128.87 103.86 7.28 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.41 -173.73 13.1 Favored Glycine 0 C--N 1.354 1.558 0 C-N-CA 122.774 0.226 . . . . 0.0 112.803 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -116.57 150.01 38.71 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.583 0.753 . . . . 0.0 110.229 173.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -107.22 130.71 54.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.517 0.727 . . . . 0.0 110.641 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -101.37 148.6 24.96 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.5 mt -59.38 133.95 56.57 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 123.661 0.601 . . . . 0.0 110.051 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -76.33 -29.9 57.45 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.412 1.085 . . . . 0.0 110.673 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.44 165.61 13.11 Favored Glycine 0 C--N 1.341 0.818 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 78.6 t -67.93 -39.66 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -143.7 144.38 31.83 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.073 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.7 mt -103.68 176.22 5.22 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 -172.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -41.14 -44.1 2.45 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.391 0.676 . . . . 0.0 109.792 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -82.95 71.91 10.05 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -64.82 99.61 0.35 Allowed 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.003 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -137.32 44.66 2.25 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.397 1.079 . . . . 0.0 109.511 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -55.77 138.1 48.52 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.137 0.575 . . . . 0.0 110.684 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -67.11 -22.14 65.82 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -170.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.248 0.982 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.261 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mmm . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.378 0.132 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.7 p -133.27 20.88 4.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.339 0.656 . . . . 0.0 110.012 -178.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 110.61 114.99 3.58 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -131.07 130.65 43.49 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.699 0.799 . . . . 0.0 110.735 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -108.34 126.08 52.45 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.444 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 111' ' ' VAL . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -76.34 140.72 41.57 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.26 122.45 20.27 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -89.43 109.41 20.33 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 172.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 117.81 31.89 1.53 Allowed Glycine 0 C--N 1.338 0.687 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.22 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.408 HG13 ' CA ' ' A' ' 52' ' ' GLY . 74.6 t -61.99 110.11 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 48.51 54.4 10.56 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 124.781 1.232 . . . . 0.0 112.071 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.0 mt -97.87 165.52 11.89 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.999 0.519 . . . . 0.0 110.109 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -56.85 144.07 34.73 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.546 0.738 . . . . 0.0 110.873 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 74.86 12.17 3.61 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.502 1.521 . . . . 0.0 113.834 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -99.25 -28.57 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -99.97 81.94 2.5 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -79.32 140.02 37.64 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.428 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -124.98 29.0 6.26 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.696 0.798 . . . . 0.0 110.056 -178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 124.333 1.053 . . . . 0.0 109.787 -176.524 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.92 0.39 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.7 t -84.08 106.91 16.1 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 109.907 168.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.93 79.66 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.59 158.58 43.64 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 123.53 0.732 . . . . 0.0 110.546 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -94.79 132.89 39.08 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.53 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -114.4 139.46 49.47 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 55.1 mt -83.82 148.69 26.86 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.487 0.661 . . . . 0.0 111.925 -172.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.94 -43.26 68.54 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.053 173.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.47 -173.96 50.85 Favored Glycine 0 C--N 1.357 1.736 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.655 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t 81.33 -55.0 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 126.002 1.721 . . . . 0.0 112.478 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -53.42 111.15 0.65 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.363 1.865 . . . . 0.0 112.33 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.7 mt -107.02 150.79 26.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.766 1.226 . . . . 0.0 108.534 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -85.13 145.28 27.71 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -111.64 24.85 12.27 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -84.99 146.2 27.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.434 0.694 . . . . 0.0 110.008 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.7 39.83 3.31 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -72.28 -19.39 61.69 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.329 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.61 135.94 57.64 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.934 0.894 . . . . 0.0 110.462 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 . . . . . 0 C--O 1.246 0.908 0 C-N-CA 124.581 1.152 . . . . 0.0 108.934 -179.633 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.488 ' H ' HG23 ' A' ' 28' ' ' VAL . 99.8 p -150.74 7.27 0.55 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.46 0.704 . . . . 0.0 110.968 162.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.67 -89.65 1.49 Allowed Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 -167.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -122.78 165.11 17.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.747 0.819 . . . . 0.0 111.497 -168.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -120.91 140.08 52.32 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -176.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.442 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.488 HG23 ' H ' ' A' ' 2' ' ' SER . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' HA ' HD21 ' A' ' 108' ' ' LEU . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -76.26 134.14 39.88 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' LYS . 55.1 tp -81.27 127.53 32.81 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 58.33 20.95 7.76 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.675 1.19 . . . . 0.0 111.687 -174.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.56 64.0 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 -178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -105.84 -0.54 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 123.187 0.595 . . . . 0.0 111.522 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -155.39 67.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.931 0.893 . . . . 0.0 108.644 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.56 -37.95 22.32 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.003 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -80.0 110.42 15.37 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.346 0.658 . . . . 0.0 112.637 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -114.77 -10.48 12.4 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.914 0.886 . . . . 0.0 110.676 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -85.0 -65.0 1.06 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -87.51 64.79 8.31 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -144.16 89.93 2.07 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.124 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -125.02 44.98 2.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.139 0.975 . . . . 0.0 109.666 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 . . . . . 0 C--O 1.254 1.295 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.956 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' O ' ' C ' ' A' ' 2' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.426 ' C ' ' O ' ' A' ' 1' ' ' MET . 70.5 m -40.19 128.94 2.3 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 -163.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.17 -151.22 27.95 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -102.15 153.43 19.95 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 123.6 0.76 . . . . 0.0 110.604 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -83.1 130.33 35.11 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.489 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.489 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -112.45 132.7 54.92 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 86.7 mt -121.85 155.08 36.13 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.035 0.445 . . . . 0.0 110.569 -175.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.53 -29.78 70.45 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.554 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 61.97 -148.96 47.66 Favored Glycine 0 C--N 1.355 1.607 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.836 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 111' ' ' VAL . 29.8 m -90.91 68.27 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 57.13 45.45 20.7 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 124.525 1.13 . . . . 0.0 111.435 -174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.0 mt -100.65 155.9 17.62 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.232 0.613 . . . . 0.0 110.043 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -127.23 113.56 16.49 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.148 0.579 . . . . 0.0 109.813 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -79.58 95.33 5.84 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.642 0.777 . . . . 0.0 109.739 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -103.48 144.94 30.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.199 1.0 . . . . 0.0 109.729 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -144.96 110.85 5.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.809 0.844 . . . . 0.0 108.763 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -89.98 145.34 25.18 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -144.74 -2.71 0.82 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.943 0.897 . . . . 0.0 110.862 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 CA--C 1.556 1.204 0 C-N-CA 122.832 0.453 . . . . 0.0 110.37 -179.197 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HG2' ' HG2' ' A' ' 29' ' ' ARG . 65.6 mtm . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -137.57 113.99 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.996 0.918 . . . . 0.0 110.157 172.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.31 103.82 0.73 Allowed Glycine 0 C--N 1.354 1.571 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.369 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -120.19 154.33 34.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.156 0.582 . . . . 0.0 109.764 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -103.55 129.96 50.86 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 48' ' ' ILE . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.48 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.403 ' HA ' ' CG1' ' A' ' 48' ' ' ILE . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.403 ' CG1' ' HA ' ' A' ' 45' ' ' MET . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -143.65 158.14 43.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.55 164.77 11.79 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.798 0.839 . . . . 0.0 109.438 -178.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -94.76 112.53 24.26 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.9 76.21 0.29 Allowed Glycine 0 C--N 1.334 0.464 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -175.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.72 -47.63 90.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.852 0.358 . . . . 0.0 110.415 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -103.75 102.96 12.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 173.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.21 -40.03 11.77 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -153.49 139.86 18.62 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.224 1.41 . . . . 0.0 108.431 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.3 t-80 -64.66 150.41 47.18 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -84.96 10.98 10.32 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.122 0.963 . . . . 0.0 110.017 -168.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -59.53 -24.01 63.32 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 124.486 1.115 . . . . 0.0 111.268 176.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 64.0 t-80 -72.82 116.0 12.79 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.819 0.818 . . . . 0.0 111.106 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -129.78 -36.73 1.58 Allowed 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.253 1.286 0 CA-C-N 113.944 -1.48 . . . . 0.0 107.474 179.762 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mtm . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -132.64 149.55 52.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 156.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.97 -166.6 14.65 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 168.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -100.26 147.04 26.2 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.755 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -90.15 132.47 35.43 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HA ' HD11 ' A' ' 108' ' ' LEU . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -116.72 145.58 43.37 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.473 HD23 ' C ' ' A' ' 108' ' ' LEU . 7.4 tt -139.28 135.09 33.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.847 1.259 . . . . 0.0 107.727 -173.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.9 111.54 23.83 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.993 0.425 . . . . 0.0 111.626 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -123.36 75.04 0.38 Allowed Glycine 0 C--N 1.342 0.867 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -74.9 -46.25 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.46 1.104 . . . . 0.0 111.592 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -119.37 100.48 7.33 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.96 140.97 29.14 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.115 0.566 . . . . 0.0 109.916 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -91.54 150.83 21.02 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.796 175.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -133.74 71.28 1.46 Allowed 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 121.76 0.791 . . . . 0.0 109.853 -175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -61.49 139.95 58.15 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -63.35 67.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 125.49 1.516 . . . . 0.0 114.803 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m170 -111.57 154.86 24.21 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.18 1.792 . . . . 0.0 107.904 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -135.06 65.37 1.56 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.8 0.81 . . . . 0.0 110.053 -178.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 . . . . . 0 N--CA 1.484 1.228 0 C-N-CA 123.854 0.862 . . . . 0.0 109.329 -178.221 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mmm . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -82.93 -137.3 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.821 0.819 . . . . 0.0 109.802 169.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.16 -120.29 10.33 Favored Glycine 0 C--N 1.341 0.843 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.387 174.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -116.9 145.35 43.65 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.269 0.627 . . . . 0.0 110.647 -172.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -107.29 136.23 47.46 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -173.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -136.08 129.83 32.49 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.5 mt -130.13 156.39 44.63 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 124.009 0.924 . . . . 0.0 109.345 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -78.75 67.78 4.57 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -67.42 141.61 39.28 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.92 -177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 93.4 t -127.28 118.72 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -73.1 103.77 3.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.806 0.691 . . . . 0.0 109.796 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.9 mt -94.83 -0.94 53.68 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.358 0.663 . . . . 0.0 110.544 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -85.4 105.1 15.79 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.238 0.542 . . . . 0.0 109.961 -175.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -85.48 143.8 28.33 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.114 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 57.58 41.0 26.39 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.218 1.007 . . . . 0.0 108.468 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -72.02 -9.08 57.88 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.473 -1.239 . . . . 0.0 113.003 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -91.52 -9.35 44.71 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.579 0.352 . . . . 0.0 111.324 172.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -102.78 145.96 28.96 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 0.0 109.734 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 . . . . . 0 CA--C 1.556 1.196 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.82 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HB2' ' CE2' ' A' ' 26' ' ' TYR . 94.4 mmm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.7 m -149.48 4.8 0.6 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.989 0.916 . . . . 0.0 112.101 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.66 -139.71 10.61 Favored Glycine 0 C--N 1.348 1.21 0 O-C-N 123.308 0.38 . . . . 0.0 113.423 -161.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.28 158.61 36.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.903 0.881 . . . . 0.0 108.72 -173.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -103.8 130.85 51.39 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 1' ' ' MET . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -147.46 120.2 8.64 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.509 ' O ' HD22 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -90.11 158.74 17.14 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 123.651 0.78 . . . . 0.0 111.283 -174.487 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.75 145.93 24.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.276 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 110.61 -36.37 4.29 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.6 t -101.5 -52.91 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.663 0.785 . . . . 0.0 110.611 170.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -109.84 76.18 0.98 Allowed 'General case' 0 C--O 1.24 0.571 0 C-N-CA 123.795 0.838 . . . . 0.0 109.069 168.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 tp -65.0 128.06 34.19 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.719 -167.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 53.73 45.22 28.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.824 1.25 . . . . 0.0 112.801 175.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -73.17 -54.78 7.6 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -91.04 70.05 6.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -79.47 5.76 12.02 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.565 1.146 . . . . 0.0 113.292 -178.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -153.38 165.18 36.58 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 109.469 -178.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -70.76 134.03 47.07 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.529 0.732 . . . . 0.0 110.062 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.8 m80 . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.631 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.233 0.54 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 4' ' ' LYS . 30.6 t -79.22 -149.61 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.09 65.23 1.25 Allowed Glycine 0 C--N 1.337 0.6 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -165.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' N ' ' O ' ' A' ' 2' ' ' SER . 99.2 mttt -139.71 147.55 41.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.329 0.652 . . . . 0.0 110.753 167.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.3 121.89 22.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.169 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.455 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 48' ' ' ILE . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 118' ' ' HIS . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.486 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.557 ' HA ' HD21 ' A' ' 108' ' ' LEU . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.431 HG21 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -89.36 140.3 29.64 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 49' ' ' LYS . 63.8 tp -75.54 139.48 42.17 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 175.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 78.06 -37.36 0.23 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.423 1.889 . . . . 0.0 109.649 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -60.02 -40.59 97.22 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 171.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.05 94.96 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 173.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -160.3 122.41 3.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.013 0.925 . . . . 0.0 108.933 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.8 mt -115.72 172.05 7.37 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 168.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -75.64 64.61 1.71 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.468 1.107 . . . . 0.0 111.969 -176.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.17 65.7 1.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.151 1.381 . . . . 0.0 108.159 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -81.65 103.45 11.36 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.34 1.067 . . . . 0.0 108.709 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -100.48 -36.25 9.26 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.908 -174.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' HIS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 46' ' ' ASP . 21.9 t-160 -72.34 106.56 4.53 Favored 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 124.409 1.084 . . . . 0.0 110.002 -178.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -136.05 44.36 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.25 1.02 . . . . 0.0 109.322 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.25 1.079 0 C-N-CA 123.727 0.811 . . . . 0.0 109.558 -177.38 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mmm . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 t -167.23 31.03 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.582 0.753 . . . . 0.0 111.055 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.78 -111.92 3.46 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.556 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -109.76 149.72 29.38 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.982 0.913 . . . . 0.0 110.366 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.04 140.04 50.33 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -174.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.424 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 36' ' ' LYS . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.436 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB3' HD22 ' A' ' 25' ' ' LEU . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 51' ' ' LEU . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -92.92 154.1 18.39 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -67.23 131.03 44.96 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.809 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -52.78 -42.38 64.98 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.968 0.907 . . . . 0.0 111.769 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 169.29 163.25 23.0 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.143 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.7 t -97.93 130.37 46.78 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.7 t0 54.71 61.95 2.75 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 125.061 1.345 . . . . 0.0 110.064 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.28 139.53 38.87 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.347 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -90.39 -22.45 21.47 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.042 0.937 . . . . 0.0 109.275 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.11 69.92 10.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -141.6 -5.98 1.03 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 177.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -86.59 65.0 8.82 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -165.76 175.51 8.71 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 108.286 -177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -61.23 136.55 58.09 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.469 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mmm . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 99.0 p -47.05 141.12 4.42 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.27 -155.29 31.83 Favored Glycine 0 C--N 1.334 0.455 0 N-CA-C 108.986 -1.645 . . . . 0.0 108.986 -168.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -95.91 163.19 13.26 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.512 0.725 . . . . 0.0 111.417 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -91.64 133.02 35.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.499 0.72 . . . . 0.0 109.065 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.427 HD13 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.448 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 108' ' ' LEU . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -150.59 136.41 18.27 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 49' ' ' LYS . 68.4 mt -128.58 138.36 52.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.52 0.728 . . . . 0.0 109.672 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -82.69 -62.23 1.66 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.766 0.826 . . . . 0.0 108.794 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 166.46 111.56 0.25 Allowed Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.045 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.5 t -98.9 128.47 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 122.973 0.509 . . . . 0.0 110.846 -176.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -77.94 79.81 4.4 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.031 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.35 83.13 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -56.86 -40.75 76.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.105 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.97 133.93 7.3 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.032 1.333 . . . . 0.0 107.94 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -95.48 138.75 32.73 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -118.8 165.94 13.41 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.146 0.578 . . . . 0.0 109.879 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -55.28 125.06 19.13 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.968 0.907 . . . . 0.0 110.069 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -78.33 122.86 26.3 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.925 0.766 . . . . 0.0 110.097 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.475 ' HB3' ' HB2' ' A' ' 26' ' ' TYR . 58.8 mtt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p -140.07 16.67 2.45 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.778 1.231 . . . . 0.0 111.043 157.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.2 -129.78 6.38 Favored Glycine 0 C--N 1.343 0.938 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -167.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -113.77 148.58 36.27 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 123.505 0.722 . . . . 0.0 110.129 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt -98.9 124.36 43.78 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.201 -163.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.475 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE2' ' HG2' ' A' ' 1' ' ' MET . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -140.28 153.4 46.48 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.7 mt -123.56 144.8 49.34 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.454 176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -90.7 -19.68 23.31 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.597 0.759 . . . . 0.0 109.383 176.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 86.17 -60.3 4.6 Favored Glycine 0 C--N 1.342 0.88 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.746 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.5 m -87.09 160.05 3.02 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 123.557 0.743 . . . . 0.0 109.976 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -68.03 146.37 53.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.713 0.405 . . . . 0.0 110.546 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.27 -20.91 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.056 0.942 . . . . 0.0 113.372 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -90.13 -152.89 0.27 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 118.118 0.417 . . . . 0.0 110.498 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -69.67 72.69 0.37 Allowed 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -52.7 130.0 31.26 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.135 0.493 . . . . 0.0 111.81 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -91.02 135.02 34.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -80.85 93.61 6.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -80.8 144.91 31.73 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.244 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 -177.352 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.586 ' O ' ' HB2' ' A' ' 2' ' ' SER . 99.2 mmm . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.823 0.345 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.586 ' HB2' ' O ' ' A' ' 1' ' ' MET . 31.9 t 170.5 166.19 0.07 Allowed 'General case' 0 C--O 1.244 0.801 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.755 164.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -86.02 -80.14 1.16 Allowed Glycine 0 C--N 1.344 1.027 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 156.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -96.57 152.14 18.92 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.008 0.523 . . . . 0.0 110.993 178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -99.71 141.95 31.84 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 2' ' ' SER . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.433 ' N ' ' HB2' ' A' ' 2' ' ' SER . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HA ' HD11 ' A' ' 108' ' ' LEU . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.457 ' HB2' ' HG ' ' A' ' 108' ' ' LEU . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -85.31 137.47 32.94 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.7 tm? -71.54 129.99 40.12 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.962 0.905 . . . . 0.0 109.767 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 74.88 -67.14 0.26 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.793 1.237 . . . . 0.0 109.684 177.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.79 66.39 3.75 Favored Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 176.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.3 t -72.61 81.8 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-O 121.923 0.868 . . . . 0.0 111.798 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -170.76 157.75 5.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.79 1.236 . . . . 0.0 108.706 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.6 mt -105.94 -26.97 11.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.598 0.759 . . . . 0.0 110.008 173.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -94.85 77.32 3.63 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.618 0.767 . . . . 0.0 111.669 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.96 70.38 10.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.592 0.757 . . . . 0.0 109.705 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -76.56 135.24 39.26 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.117 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -138.06 65.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.109 0.963 . . . . 0.0 108.554 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -96.44 129.11 43.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.616 0.766 . . . . 0.0 109.852 -178.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -59.61 121.32 11.3 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.9 m170 . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 124.317 1.047 . . . . 0.0 109.541 -179.793 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mtp . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.79 0.805 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.9 t -110.68 -65.01 1.2 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.088 -172.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.94 115.03 0.39 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -136.35 144.34 44.56 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.274 0.559 . . . . 0.0 111.002 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -106.73 121.56 44.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.477 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.472 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.472 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -139.79 141.07 36.78 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.2 tp -72.66 123.53 23.44 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.934 0.894 . . . . 0.0 108.815 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 62.01 9.99 3.38 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 126.114 1.765 . . . . 0.0 114.445 -166.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -91.05 -33.47 8.18 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 170.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -78.06 -155.03 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.341 0 C-N-CA 125.1 1.36 . . . . 0.0 110.241 171.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -57.63 116.57 3.48 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.27 0.628 . . . . 0.0 111.354 178.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.05 145.42 54.47 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.776 0.831 . . . . 0.0 109.388 -176.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -111.48 165.89 11.6 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.03 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -68.06 -23.29 64.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.5 0.72 . . . . 0.0 110.59 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 64.3 t-80 -100.42 131.3 46.42 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -75.11 117.61 17.13 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 124.053 0.845 . . . . 0.0 111.473 176.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -110.45 172.05 7.09 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -177.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -58.85 138.13 57.44 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 118.393 0.542 . . . . 0.0 111.104 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 125.147 1.379 . . . . 0.0 108.445 179.341 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 26' ' ' TYR . 74.7 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 119.977 -0.059 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.594 ' HB3' ' HA ' ' A' ' 27' ' ' ALA . 39.8 t -166.72 -95.94 0.01 OUTLIER 'General case' 0 C--O 1.246 0.898 0 C-N-CA 123.469 0.708 . . . . 0.0 110.695 -165.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.474 ' O ' ' CD2' ' A' ' 26' ' ' TYR . . . -119.84 -133.9 4.67 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -42.33 143.04 0.68 Allowed 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.536 1.134 . . . . 0.0 110.199 -156.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt -98.88 135.29 40.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -166.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 2' ' ' SER . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HA ' ' HB3' ' A' ' 2' ' ' SER . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.467 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 58' ' ' ILE . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 112' ' ' ASP . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.411 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.53 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.53 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -84.82 134.94 34.29 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.412 HD22 ' HE3' ' A' ' 45' ' ' MET . 35.8 tp -105.42 122.87 46.88 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 48.21 -70.51 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 126.514 1.926 . . . . 0.0 114.161 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 134.16 6.85 2.37 Favored Glycine 0 C--N 1.344 1.004 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 -173.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.4 t -79.02 131.19 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 122.225 1.012 . . . . 0.0 111.937 167.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 54' ' ' LYS . 68.4 t0 -138.39 98.18 3.54 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.326 -1.306 . . . . 0.0 107.928 -176.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -87.67 86.71 7.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.163 0.985 . . . . 0.0 109.813 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -76.84 -36.65 56.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.023 0.929 . . . . 0.0 112.288 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -128.66 -35.47 1.91 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.254 0.621 . . . . 0.0 109.824 -176.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -85.45 66.05 9.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.52 0.728 . . . . 0.0 110.023 178.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -74.91 139.95 43.44 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.606 1.162 . . . . 0.0 112.876 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -64.58 135.31 55.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.366 0.667 . . . . 0.0 110.407 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 34.0 p80 -66.81 166.43 13.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.945 0.898 . . . . 0.0 110.551 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 122.882 0.473 . . . . 0.0 110.562 179.768 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt . . . . . 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.451 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt . . . . . 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.443 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.443 HG13 HD13 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.43 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.43 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 . . . . . 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 . . . . . 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt . . . . . 0 CA--C 1.541 0.62 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.456 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 . . . . . 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 120.92 0.391 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 . . . . . 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.444 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 . . . . . 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.53 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 . . . . . 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt . . . . . 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.442 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 . . . . . 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.489 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.489 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 . . . . . 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt . . . . . 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 48' ' ' ILE . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.403 ' HA ' ' CG1' ' A' ' 48' ' ' ILE . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.403 ' CG1' ' HA ' ' A' ' 45' ' ' MET . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt . . . . . 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt . . . . . 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 . . . . . 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt . . . . . 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.455 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 48' ' ' ILE . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.486 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.431 HG21 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.424 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 36' ' ' LYS . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.436 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB3' HD22 ' A' ' 25' ' ' LEU . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 51' ' ' LEU . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 . . . . . 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.427 HD13 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 . . . . . 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt . . . . . 0 C--O 1.24 0.553 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.47 ' CZ ' ' HB2' ' A' ' 5' ' ' LYS . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt . . . . . 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.477 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.472 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.472 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt . . . . . 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 5' ' ' LYS . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.467 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 58' ' ' ILE . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.411 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.53 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.53 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 . . . . . 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 29.2 t -68.52 161.79 27.09 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.076 0.95 . . . . 0.0 108.478 -162.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.63 -158.12 32.31 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -175.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.51 155.61 35.1 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.601 0.76 . . . . 0.0 111.362 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -94.99 140.92 29.27 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.42 142.75 36.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 170.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -104.61 125.98 51.26 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.76 118.85 58.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 125.039 1.336 . . . . 0.0 108.226 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 64.2 tt0 -104.4 118.18 35.99 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 178.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 81.5 t -111.29 119.84 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -119.93 117.73 28.86 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -125.09 132.19 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.5 m -113.29 126.97 55.98 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.604 0.762 . . . . 0.0 110.021 177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.4 t -134.51 134.81 41.86 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.609 1.164 . . . . 0.0 110.039 173.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 54.96 23.19 4.87 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.7 1.2 . . . . 0.0 112.179 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.87 9.42 80.92 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-N 116.303 -0.408 . . . . 0.0 113.037 -177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -111.32 129.88 55.85 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.955 0.902 . . . . 0.0 109.846 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.9 m -105.58 127.78 53.23 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.128 -172.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -112.39 117.71 33.18 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 107.37 -1.345 . . . . 0.0 107.37 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -139.14 143.37 38.17 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -158.9 141.87 14.51 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.039 0.936 . . . . 0.0 109.567 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 97.7 m -96.34 131.83 42.46 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.054 173.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.69 147.54 42.83 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.759 0.823 . . . . 0.0 109.13 -176.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -104.95 116.63 32.29 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.7 mt -110.66 110.37 21.02 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.827 0.851 . . . . 0.0 109.325 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -116.98 117.19 28.98 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.264 0.626 . . . . 0.0 109.637 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.03 155.62 48.64 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.795 0.838 . . . . 0.0 109.506 -167.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.545 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.7 t -88.36 -52.95 10.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 176.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -101.91 155.91 17.86 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.255 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -60.23 -39.97 88.56 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.449 1.5 . . . . 0.0 110.045 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -63.1 -36.84 84.92 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.766 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -68.76 -41.64 78.6 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.46 0.704 . . . . 0.0 111.642 177.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.2 -40.0 95.17 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 122.965 0.506 . . . . 0.0 110.015 176.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -58.48 -49.56 76.91 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.359 0.663 . . . . 0.0 112.497 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.12 -26.57 64.96 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.961 0.788 . . . . 0.0 112.127 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.51 -43.49 80.75 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.332 0.653 . . . . 0.0 110.188 173.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 65.8 mt -60.18 -41.34 92.71 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.165 0.986 . . . . 0.0 110.836 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.87 -44.64 94.07 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.105 0.962 . . . . 0.0 111.25 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.44 -44.26 91.7 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 123.437 0.461 . . . . 0.0 110.868 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -61.92 -45.22 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 124.165 0.986 . . . . 0.0 111.621 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 74.8 mt -63.77 -45.04 91.56 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.911 0.484 . . . . 0.0 110.255 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -62.37 -38.95 91.52 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.108 0.563 . . . . 0.0 111.699 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 tm-20 -61.64 -42.58 99.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.249 0.62 . . . . 0.0 110.758 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.03 -22.09 59.7 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.782 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -94.14 -15.01 25.06 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.628 0.771 . . . . 0.0 112.01 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -54.62 -56.06 31.22 Favored Pre-proline 0 CA--C 1.563 1.46 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.451 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 65.3 Cg_endo -72.54 -17.9 26.22 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 121.764 1.643 . . . . 0.0 111.759 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.0 mm -80.44 -29.96 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.065 0 C-N-CA 124.032 0.933 . . . . 0.0 110.995 -175.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -75.42 -34.17 61.01 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.385 0.674 . . . . 0.0 109.69 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -64.02 -22.78 67.07 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.885 0.874 . . . . 0.0 110.882 171.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 96.1 mt -90.97 -28.2 18.18 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.76 37.95 76.41 Favored Glycine 0 C--N 1.352 1.44 0 O-C-N 123.842 0.714 . . . . 0.0 112.001 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 77.1 m -58.26 124.84 20.81 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 122.997 0.519 . . . . 0.0 110.393 -167.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -59.7 -33.35 71.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.753 0.821 . . . . 0.0 110.834 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -156.51 136.25 12.5 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.159 0.984 . . . . 0.0 108.94 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.38 151.97 32.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 123.306 0.642 . . . . 0.0 109.624 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -122.6 126.64 48.11 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.3 mt -115.47 126.19 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.953 1.301 . . . . 0.0 107.57 -177.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.0 m -115.94 128.2 55.57 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.4 mt -121.44 121.34 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 123.684 0.794 . . . . 0.0 108.922 -175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -110.82 130.36 55.6 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 25.1 t -111.56 136.54 47.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.471 1.109 . . . . 0.0 110.098 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.37 127.63 36.24 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 63.9 m170 -94.98 136.92 34.72 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.427 0.454 . . . . 0.0 110.092 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -59.31 -27.08 65.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.715 1.206 . . . . 0.0 112.551 -172.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -163.63 159.89 22.23 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.945 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.59 69.27 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.229 1.012 . . . . 0.0 112.819 -176.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -34.59 78.73 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 122.751 0.42 . . . . 0.0 109.896 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -67.14 -27.49 67.35 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.558 0.743 . . . . 0.0 112.573 -178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -45.82 -45.44 14.92 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -168.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -65.08 -50.92 64.27 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.388 0.675 . . . . 0.0 111.072 -174.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.14 -39.84 68.48 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.703 0.801 . . . . 0.0 109.813 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -69.05 -36.38 77.63 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.316 -175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.82 70.79 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -61.2 -41.1 96.22 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.951 0.501 . . . . 0.0 111.725 178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -61.75 -51.34 68.76 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.934 0.894 . . . . 0.0 110.702 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -71.67 -30.48 65.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.985 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.25 -40.53 77.81 Favored 'General case' 0 C--N 1.345 0.413 0 C-N-CA 123.474 0.71 . . . . 0.0 110.146 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.92 -40.68 98.34 Favored 'General case' 0 C--N 1.348 0.541 0 O-C-N 124.17 0.919 . . . . 0.0 110.762 174.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -62.66 -48.55 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 O-C-N 123.958 0.786 . . . . 0.0 111.442 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -70.15 -41.97 73.14 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.056 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -62.44 -38.3 89.2 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.991 0.516 . . . . 0.0 110.651 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.91 -39.84 90.94 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.026 175.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.3 t -64.99 -42.78 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.548 0.739 . . . . 0.0 110.37 178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -61.1 -44.64 97.04 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.01 -0.996 . . . . 0.0 110.443 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.42 68.55 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.704 0.802 . . . . 0.0 111.665 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -79.39 -19.06 51.02 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.021 0.528 . . . . 0.0 111.769 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -101.53 -8.09 22.21 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.157 0.583 . . . . 0.0 111.799 -175.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.73 20.39 14.79 Favored Glycine 0 C--N 1.348 1.213 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -93.98 139.87 30.4 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 176.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -89.63 157.78 17.88 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.685 0.794 . . . . 0.0 110.299 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.51 -33.09 72.12 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.793 0.837 . . . . 0.0 111.677 178.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -76.0 -5.33 45.84 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.229 1.012 . . . . 0.0 112.218 178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -105.62 -1.83 24.17 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.401 0.68 . . . . 0.0 111.185 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 74.3 t -116.9 123.27 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.5 0.72 . . . . 0.0 109.931 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.9 m -121.69 119.55 32.1 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.263 0.625 . . . . 0.0 110.15 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -93.34 131.63 38.31 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.9 0.48 . . . . 0.0 110.949 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -140.87 95.04 2.79 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.455 0.702 . . . . 0.0 110.328 170.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.66 -123.17 24.25 Favored Glycine 0 CA--C 1.533 1.19 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.583 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p30 -85.08 3.5 38.54 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.71 0.804 . . . . 0.0 111.098 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.1 m -124.77 130.0 51.55 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.213 0.605 . . . . 0.0 110.749 -173.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.8 p -118.54 131.5 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.8 m -109.97 120.81 43.63 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 -178.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.6 t -118.68 131.31 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -113.56 143.48 44.47 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -165.69 169.41 40.05 Favored Glycine 0 C--O 1.246 0.898 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.25 174.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -123.57 145.86 48.58 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.483 1.113 . . . . 0.0 109.826 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.7 mt -109.79 145.53 36.53 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.827 173.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.13 57.48 3.17 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 125.301 1.44 . . . . 0.0 110.485 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -108.9 -78.12 1.04 Allowed Glycine 0 N--CA 1.472 1.035 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.993 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 74.4 t -70.07 -48.08 64.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -94.52 100.88 12.78 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.539 -1.209 . . . . 0.0 108.678 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -88.85 -3.16 58.83 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.667 0.787 . . . . 0.0 111.654 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -85.57 73.1 10.52 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.661 0.743 . . . . 0.0 110.72 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.61 135.28 57.71 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 23.3 t-160 -73.73 99.98 3.29 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 123.717 0.636 . . . . 0.0 111.086 176.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -87.51 149.93 24.06 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.64 -1.164 . . . . 0.0 108.26 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -64.96 140.03 58.82 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 109.616 -0.512 . . . . 0.0 109.616 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -55.04 132.38 47.05 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.294 0.997 . . . . 0.0 112.297 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 C--O 1.249 1.05 0 CA-C-N 115.039 -0.982 . . . . 0.0 108.91 -179.249 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.476 0.839 0 CA-C-O 121.665 0.745 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.8 t -151.22 54.38 0.86 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 169.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 116.78 -163.57 12.47 Favored Glycine 0 C--N 1.334 0.459 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 169.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -120.98 157.51 29.78 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.327 0.651 . . . . 0.0 109.719 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -102.15 129.06 48.42 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.7 p -126.41 145.81 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 166.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -108.82 140.16 42.65 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.699 0.761 . . . . 0.0 109.623 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.3 118.14 56.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.046 1.338 . . . . 0.0 109.122 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -106.81 113.29 26.7 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.0 t -113.04 124.81 70.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -121.27 116.96 25.85 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.9 0.88 . . . . 0.0 108.673 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.443 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -127.19 130.01 70.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.092 0.557 . . . . 0.0 110.262 -176.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.2 m -105.01 132.65 50.98 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 t -129.55 116.64 19.21 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 60.98 -84.64 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.126 1.37 . . . . 0.0 109.477 -175.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -145.37 12.37 1.8 Allowed Glycine 0 N--CA 1.464 0.511 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -114.62 127.67 55.9 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 124.307 1.043 . . . . 0.0 108.699 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.1 m -106.81 130.4 54.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.656 0.782 . . . . 0.0 109.51 -176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -116.43 122.08 43.74 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.729 0.812 . . . . 0.0 109.626 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -129.75 142.15 50.75 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.385 0.674 . . . . 0.0 110.502 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -153.92 138.49 16.88 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.587 0.755 . . . . 0.0 109.83 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 84.4 m -96.16 129.62 43.41 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -115.23 140.88 48.71 Favored 'General case' 0 N--CA 1.479 1.008 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -102.39 118.58 37.18 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 171.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 mt -110.56 112.59 24.6 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -108.57 115.52 30.25 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.245 1.018 . . . . 0.0 109.148 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.21 149.92 35.79 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 122.444 0.298 . . . . 0.0 111.228 -171.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.4 t -88.57 -44.85 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 O-C-N 124.594 1.183 . . . . 0.0 109.575 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -112.13 156.24 22.58 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 110.158 -175.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -61.77 -40.77 96.32 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.628 0.771 . . . . 0.0 110.351 177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -65.55 -34.28 77.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.444 1.097 . . . . 0.0 110.954 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.45 -40.03 94.94 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.122 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.39 -40.03 81.48 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 123.275 0.63 . . . . 0.0 110.132 176.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.0 mtpt -55.84 -49.27 73.76 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.393 0.677 . . . . 0.0 112.776 -178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -65.1 -33.2 75.45 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.504 0.721 . . . . 0.0 111.512 177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -67.01 -39.72 87.14 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.614 0.766 . . . . 0.0 110.595 176.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 73.5 mt -61.96 -41.27 97.81 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 124.142 0.901 . . . . 0.0 110.223 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -61.38 -43.21 99.25 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.747 0.654 . . . . 0.0 110.925 176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -62.91 -44.54 95.8 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.202 0.601 . . . . 0.0 111.042 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.5 t -63.2 -45.49 98.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 C-N-CA 125.213 1.405 . . . . 0.0 111.891 176.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.6 mt -61.23 -45.04 96.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.771 177.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -67.75 -38.97 84.19 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -176.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -69.38 -23.83 63.79 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.688 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.4 mmm -93.17 -19.47 21.43 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -55.3 -58.25 16.11 Favored Pre-proline 0 CA--C 1.567 1.611 0 CA-C-O 118.805 -0.617 . . . . 0.0 112.165 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.67 -23.2 31.47 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 121.878 1.719 . . . . 0.0 112.602 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.443 HG13 HD13 ' A' ' 12' ' ' ILE . 49.7 mm -76.23 -30.51 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.995 . . . . 0.0 111.5 -174.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -71.83 -37.84 70.24 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.706 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -65.37 -23.85 67.08 Favored 'General case' 0 CA--C 1.556 1.201 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.185 174.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.41 -34.86 21.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.253 0.621 . . . . 0.0 110.419 176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.18 46.08 82.26 Favored Glycine 0 C--N 1.345 1.029 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.992 168.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.7 m -80.26 132.85 35.92 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -53.84 -69.33 0.12 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 123.631 0.582 . . . . 0.0 110.246 -174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -103.05 138.3 40.09 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.8 m -131.12 148.74 32.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.783 0 C-N-CA 124.273 1.029 . . . . 0.0 108.632 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -131.1 130.57 43.32 Favored 'General case' 0 C--O 1.241 0.642 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 179.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.8 mt -119.29 130.63 73.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.0 m -120.62 127.71 52.35 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 170.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 82.7 mt -124.66 126.61 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 123.361 0.664 . . . . 0.0 109.312 -172.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -117.44 133.05 56.4 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -109.27 144.78 16.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.639 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -88.18 130.12 35.15 Favored 'General case' 0 C--O 1.239 0.52 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -100.25 138.46 37.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.14 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.7 m -49.42 -41.77 40.73 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.635 1.174 . . . . 0.0 113.596 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -162.19 170.03 19.76 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.151 0.98 . . . . 0.0 108.735 -177.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.13 -48.64 79.21 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.37 -34.14 77.61 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -65.83 -25.61 67.29 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.631 -177.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -50.59 -36.72 36.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 125.524 1.53 . . . . 0.0 112.208 -172.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.65 -49.95 71.19 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.348 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -73.59 -36.78 65.58 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.208 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -67.27 -49.96 62.29 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.857 0.863 . . . . 0.0 111.171 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.94 -44.63 88.81 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 123.859 0.725 . . . . 0.0 110.679 -177.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -60.92 -51.35 69.67 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.298 1.039 . . . . 0.0 111.582 -178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -62.27 -50.83 70.12 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.45 1.1 . . . . 0.0 110.13 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.8 -31.44 69.34 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.005 -173.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.43 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.0 -43.57 91.53 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.613 0.765 . . . . 0.0 110.738 177.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.93 -42.17 97.43 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.208 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.6 mm -59.27 -49.87 81.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 124.032 0.933 . . . . 0.0 110.728 178.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.7 mt -65.63 -44.62 85.88 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.92 0.888 . . . . 0.0 111.201 -178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -61.62 -39.33 90.89 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.856 0.863 . . . . 0.0 109.97 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -65.5 -45.16 84.64 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.292 0.637 . . . . 0.0 111.261 174.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.74 -45.47 97.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.019 0.528 . . . . 0.0 111.378 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -64.47 -41.28 96.6 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.204 0.601 . . . . 0.0 110.9 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.11 -34.95 79.22 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.412 0.685 . . . . 0.0 111.428 176.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -74.77 -16.32 60.73 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.243 1.017 . . . . 0.0 111.123 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.2 mt -100.56 -10.84 20.61 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.943 0.897 . . . . 0.0 109.803 -177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.04 4.7 35.74 Favored Glycine 0 C--N 1.346 1.097 0 CA-C-O 119.414 -0.659 . . . . 0.0 113.124 173.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -75.06 138.21 41.98 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 117.263 0.532 . . . . 0.0 110.446 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -87.25 161.98 17.69 Favored 'General case' 0 C--O 1.244 0.814 0 C-N-CA 123.315 0.646 . . . . 0.0 109.534 -178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -53.83 -33.13 55.27 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.975 0.51 . . . . 0.0 111.468 173.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -77.27 -13.05 60.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.398 1.079 . . . . 0.0 113.04 178.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -87.95 -28.68 21.33 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.722 0.409 . . . . 0.0 110.239 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.7 t -108.23 118.18 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.952 0 C-N-CA 124.366 1.066 . . . . 0.0 109.83 -172.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.2 m -117.66 135.73 53.8 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.636 0.775 . . . . 0.0 109.083 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.43 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 78.6 m95 -109.4 129.94 55.52 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 118.277 0.49 . . . . 0.0 109.829 173.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.66 106.54 3.26 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.498 1.119 . . . . 0.0 110.2 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.85 51.49 9.16 Favored Glycine 0 C--N 1.353 1.522 0 C-N-CA 123.043 0.354 . . . . 0.0 113.033 174.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 53.28 21.58 2.35 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 126.619 1.967 . . . . 0.0 113.26 -174.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 36.4 m -128.91 137.9 51.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.613 1.165 . . . . 0.0 109.275 -174.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 p -108.18 125.68 64.84 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.4 m -113.19 121.62 45.05 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.2 t -115.81 127.49 73.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.41 145.95 47.81 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.15 -178.98 41.42 Favored Glycine 0 C--O 1.241 0.589 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 176.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -118.1 131.77 56.41 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 123.054 0.542 . . . . 0.0 110.078 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.0 tt -98.52 136.44 38.63 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -54.98 93.0 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.475 0.71 . . . . 0.0 111.23 178.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -175.04 34.93 0.1 Allowed Glycine 0 C--N 1.339 0.738 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.696 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.07 88.2 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 C-N-CA 123.689 0.795 . . . . 0.0 110.715 -170.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -175.03 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.319 -1.31 . . . . 0.0 108.09 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.5 mt -89.39 72.51 8.01 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.456 173.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -73.91 155.98 38.13 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.847 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -74.83 85.03 2.19 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.771 0.828 . . . . 0.0 111.046 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -88.12 5.39 41.51 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.79 0.436 . . . . 0.0 110.346 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.61 68.99 10.04 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -154.75 164.92 38.09 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.777 1.231 . . . . 0.0 108.422 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.0 t-80 -67.75 130.12 42.01 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.915 0.486 . . . . 0.0 110.979 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.8 t60 . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.439 1.095 . . . . 0.0 108.268 179.811 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.43 ' O ' ' N ' ' A' ' 3' ' ' GLY . 62.4 ttp . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -66.64 72.84 0.09 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.15 0.58 . . . . 0.0 110.049 -167.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 1' ' ' MET . . . 84.45 77.26 1.16 Allowed Glycine 0 C--N 1.338 0.655 0 N-CA-C 110.159 -1.176 . . . . 0.0 110.159 177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -134.71 134.93 41.59 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.548 -0.826 . . . . 0.0 110.783 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 ttpt -105.73 132.51 51.77 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 172.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 p -130.85 143.93 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -105.07 127.66 52.99 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 172.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.3 t -119.15 122.54 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.692 1.197 . . . . 0.0 108.895 -176.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.12 116.19 31.76 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.1 t -112.04 120.75 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -117.9 122.73 44.07 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -176.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.4 tt -127.3 132.32 69.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 CA-C-N 118.416 0.553 . . . . 0.0 110.982 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.5 m -102.0 125.44 48.68 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.4 t -153.98 134.6 13.59 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.425 1.09 . . . . 0.0 109.171 -175.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 77.8 -27.72 0.17 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.141 1.776 . . . . 0.0 112.463 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 133.29 -2.43 4.65 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -118.6 137.36 53.32 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 123.986 0.914 . . . . 0.0 109.648 178.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 70.9 m -96.41 125.59 41.01 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -114.23 115.45 27.46 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -177.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -134.31 144.68 48.45 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 123.321 0.649 . . . . 0.0 110.578 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -152.54 140.6 20.26 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.626 0.771 . . . . 0.0 109.702 177.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -99.17 131.32 45.29 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.648 0.779 . . . . 0.0 109.401 177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -120.02 147.35 44.91 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.78 0.832 . . . . 0.0 109.507 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -103.17 117.71 35.15 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 174.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.0 mt -119.66 124.08 45.41 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.572 1.149 . . . . 0.0 109.51 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -115.03 137.11 52.38 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.769 0.427 . . . . 0.0 110.339 173.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.07 147.42 33.77 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.4 0.68 . . . . 0.0 110.263 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 t -102.17 -23.37 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 124.632 1.173 . . . . 0.0 109.457 172.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -128.57 149.89 50.43 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -60.26 -37.12 79.44 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.539 0.335 . . . . 0.0 111.028 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -63.7 -31.82 73.11 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.302 0.641 . . . . 0.0 111.613 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.09 -40.92 87.02 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.847 0.294 . . . . 0.0 110.544 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -39.73 76.23 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.434 0.694 . . . . 0.0 111.169 178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.85 -50.8 69.6 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.725 0.81 . . . . 0.0 112.334 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.2 pt-20 -62.59 -33.85 75.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.57 0.544 . . . . 0.0 111.685 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -64.9 -45.13 87.23 Favored 'General case' 0 C--N 1.353 0.721 0 O-C-N 123.897 0.748 . . . . 0.0 110.044 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.6 mt -60.18 -43.36 95.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 124.527 1.142 . . . . 0.0 110.914 177.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -59.33 -47.58 84.87 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 123.98 0.8 . . . . 0.0 111.28 178.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -65.36 -42.92 92.28 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.601 0.76 . . . . 0.0 112.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.3 -47.01 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.256 0.622 . . . . 0.0 110.487 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.2 mt -64.5 -45.21 88.23 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.181 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -63.89 -37.82 88.8 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 0.0 111.691 175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.07 -36.52 79.83 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.113 0.565 . . . . 0.0 110.076 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -74.07 -20.65 60.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.746 0.818 . . . . 0.0 111.35 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.3 mmm -93.71 -10.05 35.7 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.294 1.038 . . . . 0.0 112.322 -175.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -68.8 -50.11 24.89 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-O 118.263 -0.875 . . . . 0.0 112.001 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.11 -15.17 20.64 Favored 'Trans proline' 0 C--N 1.391 2.783 0 C-N-CA 121.826 1.684 . . . . 0.0 111.806 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.464 HG21 HG11 ' A' ' 56' ' ' VAL . 47.4 mm -64.49 -29.98 48.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 124.804 1.242 . . . . 0.0 111.158 -176.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -72.37 -40.82 67.01 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 122.871 0.468 . . . . 0.0 110.022 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -61.99 -34.99 77.19 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.357 0.663 . . . . 0.0 110.498 172.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -76.46 -25.33 54.23 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.673 0.389 . . . . 0.0 110.005 176.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.01 41.38 32.55 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 113.408 171.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 85.3 m -91.42 94.54 9.53 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.63 -52.5 17.75 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.889 0.876 . . . . 0.0 110.742 178.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -118.54 138.22 52.68 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 176.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.464 HG11 HG21 ' A' ' 48' ' ' ILE . 35.2 m -133.0 155.51 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 123.975 0.91 . . . . 0.0 109.403 -172.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -116.16 124.53 50.55 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.7 mt -121.62 130.31 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.7 m -118.75 130.95 56.09 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 173.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.5 mp -115.89 119.02 60.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.35 1.06 . . . . 0.0 108.981 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -111.13 126.96 55.39 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.6 p -108.37 139.94 28.8 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -172.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -86.72 128.59 35.02 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 -179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -102.32 140.9 35.99 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.199 1.0 . . . . 0.0 109.141 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.0 m -57.27 -39.96 76.76 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.3 1.0 . . . . 0.0 111.581 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -162.95 167.4 22.63 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.881 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.7 -34.69 76.08 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 178.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.44 -43.73 89.51 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.127 0.571 . . . . 0.0 110.238 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -69.04 -29.9 68.14 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 114.964 -1.016 . . . . 0.0 113.294 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -48.55 -44.7 36.7 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.402 1.081 . . . . 0.0 112.606 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.41 79.9 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 114.166 -1.379 . . . . 0.0 111.85 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.53 -41.89 71.95 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.64 0.776 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -69.27 -34.93 75.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.314 0.646 . . . . 0.0 110.114 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.39 91.58 Favored 'General case' 0 C--N 1.35 0.629 0 O-C-N 123.886 0.741 . . . . 0.0 110.614 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.23 -41.74 93.76 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.422 173.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -61.26 -48.56 80.84 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.447 0.642 . . . . 0.0 109.833 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -68.53 -33.08 73.48 Favored 'General case' 0 C--O 1.214 -0.813 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.81 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.68 74.67 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 117.907 0.322 . . . . 0.0 110.677 175.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.74 -47.93 67.87 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.23 0.612 . . . . 0.0 111.596 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 35.1 mm -62.79 -47.98 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.175 0.99 . . . . 0.0 111.47 -175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 47.1 mt -69.88 -36.87 75.81 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.784 0.834 . . . . 0.0 111.152 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.81 -38.67 91.61 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.249 0.619 . . . . 0.0 109.979 177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -67.79 -38.16 82.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.306 176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.91 -46.67 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.681 0.793 . . . . 0.0 110.615 174.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 23.0 m-30 -61.96 -40.64 96.28 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.676 0.79 . . . . 0.0 111.191 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.5 -29.73 70.77 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.306 0.642 . . . . 0.0 111.246 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -83.3 -12.36 56.74 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.76 0.824 . . . . 0.0 110.595 -178.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -101.6 -4.75 26.08 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.208 1.003 . . . . 0.0 110.367 -178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.2 19.36 55.59 Favored Glycine 0 C--N 1.35 1.33 0 C-N-CA 123.234 0.445 . . . . 0.0 114.191 -178.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -93.03 136.05 33.64 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.431 0.692 . . . . 0.0 110.075 -177.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -80.18 144.15 33.23 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.815 0.846 . . . . 0.0 110.682 177.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -55.58 -41.1 72.87 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.97 0.908 . . . . 0.0 111.24 179.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.2 m -60.36 -40.48 90.91 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.115 0.966 . . . . 0.0 111.119 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -76.22 0.45 19.08 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.541 0.736 . . . . 0.0 111.216 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.6 t -104.72 117.67 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.143 0.977 . . . . 0.0 110.234 174.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -124.68 121.99 36.23 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.114 0.566 . . . . 0.0 109.894 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 54.2 m95 -89.99 135.78 33.44 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.917 0.887 . . . . 0.0 109.871 177.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -141.6 89.43 2.21 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.468 1.107 . . . . 0.0 108.036 173.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.42 -117.05 7.47 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-N 115.281 -0.872 . . . . 0.0 113.598 -179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -91.87 1.93 56.86 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.125 0.97 . . . . 0.0 111.801 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.1 m -126.46 132.29 51.49 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.662 0.785 . . . . 0.0 109.26 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -116.61 131.19 69.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 124.09 0.956 . . . . 0.0 109.026 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.0 m -109.5 121.54 45.43 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.9 t -120.83 130.62 74.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 123.785 0.834 . . . . 0.0 108.778 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -110.28 139.41 45.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -155.32 179.86 31.0 Favored Glycine 0 C--N 1.335 0.501 0 O-C-N 123.739 0.65 . . . . 0.0 112.25 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -124.14 151.77 43.59 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 123.711 0.804 . . . . 0.0 108.927 -178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.8 mt -64.12 129.3 39.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.653 178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 49.99 36.09 11.09 Favored 'General case' 0 CA--C 1.559 1.305 0 O-C-N 124.297 0.998 . . . . 0.0 110.583 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -58.32 -44.79 94.92 Favored Glycine 0 C--N 1.352 1.451 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.513 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 84.3 t -124.96 -75.03 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 173.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -179.43 125.17 0.08 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.366 1.866 . . . . 0.0 107.165 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.48 -67.25 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -169.97 -179.98 3.4 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.584 -1.643 . . . . 0.0 106.936 175.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.5 t-80 -80.13 132.44 35.93 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.632 0.373 . . . . 0.0 110.52 174.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -64.31 117.88 7.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.402 0.681 . . . . 0.0 110.822 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 63.8 t-80 -100.11 163.69 12.31 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -54.85 -40.65 69.87 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.877 0.871 . . . . 0.0 112.57 173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -151.98 167.89 26.94 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.398 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.247 0.93 0 C-N-CA 123.765 0.826 . . . . 0.0 108.931 -179.951 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mmm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.692 0.282 . . . . 0.0 110.553 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.1 m -73.36 -40.83 64.09 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.664 0.786 . . . . 0.0 110.353 -165.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.8 -163.6 10.14 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.444 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -146.99 139.63 24.95 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 163.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -116.25 134.04 55.35 Favored 'General case' 0 C--N 1.351 0.664 0 CA-C-O 121.194 0.521 . . . . 0.0 109.619 -176.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -134.62 146.57 30.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-N 115.058 -0.973 . . . . 0.0 109.795 176.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.7 mt-10 -105.45 132.06 52.1 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.8 t -121.98 120.09 60.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 124.864 1.266 . . . . 0.0 108.735 -175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -101.33 117.84 35.78 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.39 120.47 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -118.15 120.92 39.18 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.236 1.014 . . . . 0.0 108.313 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.474 HD13 HG13 ' A' ' 48' ' ' ILE . 18.6 tt -125.55 135.13 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.543 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.7 m -102.75 123.91 47.29 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.025 0.93 . . . . 0.0 109.335 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.456 ' SG ' HG23 ' A' ' 48' ' ' ILE . 29.9 t -152.47 140.77 20.5 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 108.809 177.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.38 29.98 19.62 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.078 1.351 . . . . 0.0 110.508 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.32 4.43 60.2 Favored Glycine 0 C--N 1.353 1.507 0 CA-C-N 115.428 -0.805 . . . . 0.0 113.91 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -105.97 153.52 21.89 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.929 0.892 . . . . 0.0 110.606 -175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.9 m -102.23 122.32 43.96 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.557 0.743 . . . . 0.0 110.545 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -116.35 111.24 19.8 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -139.41 146.46 40.17 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 118.376 0.534 . . . . 0.0 111.97 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -157.04 142.69 17.58 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 114.918 -1.037 . . . . 0.0 108.717 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.7 m -97.72 134.95 40.21 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.77 0.828 . . . . 0.0 109.8 176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -117.69 143.31 46.31 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.222 1.009 . . . . 0.0 109.0 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -99.47 117.25 33.46 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 173.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 72.7 mt -112.56 106.83 15.36 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 123.545 0.738 . . . . 0.0 109.333 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -108.92 110.74 22.13 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.464 176.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.37 153.81 48.94 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.86 0.864 . . . . 0.0 109.486 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.86 -33.49 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.267 0.627 . . . . 0.0 109.481 -176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.2 mtm180 -120.9 150.24 41.38 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.942 0.897 . . . . 0.0 109.738 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.26 -38.3 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.515 0.726 . . . . 0.0 109.917 178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.33 -36.35 83.41 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.078 0.951 . . . . 0.0 111.44 177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 97.2 mt-10 -66.21 -40.77 90.6 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.548 0.739 . . . . 0.0 111.245 176.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.56 -40.01 92.35 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.792 0.837 . . . . 0.0 110.733 176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -57.49 -51.35 69.83 Favored 'General case' 0 C--N 1.363 1.154 0 C-N-CA 123.179 0.592 . . . . 0.0 112.348 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.81 -32.06 73.44 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.998 0.811 . . . . 0.0 111.672 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 68.2 mttm -64.63 -43.17 94.55 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.913 0.885 . . . . 0.0 110.254 175.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.84 -38.93 92.92 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.729 0.812 . . . . 0.0 111.919 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -59.34 -45.65 90.79 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.637 0.775 . . . . 0.0 111.487 173.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -66.33 -44.21 84.01 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 122.613 0.365 . . . . 0.0 111.196 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.37 -45.8 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.374 0.67 . . . . 0.0 111.586 177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.4 mt -64.17 -44.98 90.39 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.105 0.562 . . . . 0.0 110.957 177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -64.86 -41.39 95.71 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -69.55 -43.0 73.85 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.242 0.217 . . . . 0.0 110.642 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -64.99 -38.46 91.04 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.655 0.382 . . . . 0.0 111.555 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.0 mtp -90.59 -13.59 34.16 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -174.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -49.4 -52.0 53.21 Favored Pre-proline 0 CA--C 1.569 1.686 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.59 178.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.63 -16.67 38.24 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 122.222 1.948 . . . . 0.0 113.553 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 12' ' ' ILE . 49.0 mm -74.0 -28.97 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.589 0.756 . . . . 0.0 110.488 -175.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.89 -40.78 72.03 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.892 0.877 . . . . 0.0 109.553 175.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.56 -28.39 69.84 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.56 1.144 . . . . 0.0 110.713 173.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.3 mt -79.64 -26.9 40.96 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 176.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.35 40.91 12.34 Favored Glycine 0 C--N 1.345 1.05 0 O-C-N 123.884 0.74 . . . . 0.0 112.328 169.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 94.8 m -85.86 104.85 15.91 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -50.73 -49.54 57.52 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.976 1.31 . . . . 0.0 112.164 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -120.88 143.21 49.04 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.3 m -133.44 152.72 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 123.56 0.744 . . . . 0.0 109.062 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -117.85 126.22 51.99 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.4 mt -122.7 123.81 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -178.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 60.5 m -113.66 127.41 56.03 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.2 mt -119.57 122.99 70.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.004 0.922 . . . . 0.0 108.764 -176.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -110.59 130.14 55.63 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 173.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.5 p -105.99 140.41 24.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.844 -1.539 . . . . 0.0 106.844 -173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -83.75 130.69 34.95 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -102.59 144.8 30.54 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 114.855 -1.066 . . . . 0.0 108.258 -176.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.8 m -66.08 -41.57 90.54 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.069 0.948 . . . . 0.0 111.334 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -163.21 169.87 18.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.489 1.115 . . . . 0.0 108.691 -176.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -65.53 -34.19 77.69 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.524 0.73 . . . . 0.0 112.837 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.64 -40.36 69.76 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.405 0.682 . . . . 0.0 110.4 174.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -70.73 -37.52 73.5 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.073 -173.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 25.7 pt-20 -56.29 -26.46 52.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.416 0.686 . . . . 0.0 111.113 -171.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.95 -48.01 75.6 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.829 0.452 . . . . 0.0 109.866 -178.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -74.27 -40.94 61.99 Favored 'General case' 0 C--N 1.346 0.451 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.755 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -68.85 -38.6 79.9 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.1 -48.06 77.6 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 118.139 0.427 . . . . 0.0 110.966 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.78 -44.45 96.86 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.666 0.786 . . . . 0.0 111.094 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -60.62 -51.72 68.18 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.464 1.506 . . . . 0.0 110.414 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -70.06 -31.8 69.58 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.492 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.46 -41.49 76.61 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.883 0.873 . . . . 0.0 110.509 176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.38 -41.64 93.52 Favored 'General case' 0 C--N 1.354 0.778 0 O-C-N 124.009 0.818 . . . . 0.0 110.878 173.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.51 -51.97 66.82 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 C-N-CA 123.614 0.765 . . . . 0.0 110.941 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.55 -35.7 81.62 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.71 0.804 . . . . 0.0 110.947 179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.38 -43.3 96.74 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.782 0.833 . . . . 0.0 110.528 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -69.36 -42.18 75.57 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.502 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.8 t -65.0 -50.67 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.078 0.951 . . . . 0.0 110.598 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.7 m-85 -64.96 -37.69 88.48 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.104 0.962 . . . . 0.0 111.596 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.5 -29.97 70.93 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.578 0.751 . . . . 0.0 111.875 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -80.96 -17.09 51.61 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.456 0.702 . . . . 0.0 111.878 176.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.02 -6.56 23.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.743 0.417 . . . . 0.0 110.51 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.11 17.19 19.0 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-N 116.287 -0.415 . . . . 0.0 113.421 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.4 m-85 -96.19 137.13 35.7 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -88.53 152.17 22.03 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.671 0.788 . . . . 0.0 110.06 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -56.26 -37.14 69.37 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.271 1.429 . . . . 0.0 111.371 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 91.9 p -70.52 -3.62 18.88 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.759 1.223 . . . . 0.0 113.401 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.504 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 94.8 m-20 -109.78 4.44 21.78 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.398 1.079 . . . . 0.0 111.881 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.2 t -114.93 121.27 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.635 0.774 . . . . 0.0 109.662 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.8 m -123.02 118.53 27.99 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.965 0.906 . . . . 0.0 110.769 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -91.89 138.53 31.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.034 0.534 . . . . 0.0 111.263 173.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -122.26 67.69 0.94 Allowed 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 169.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 100' ' ' ASP . . . 39.53 30.07 0.17 Allowed Glycine 0 N--CA 1.488 2.136 0 N-CA-C 118.053 1.981 . . . . 0.0 118.053 171.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' GLY . 62.2 t0 171.41 -44.98 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.106 0.953 . . . . 0.0 110.631 -177.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.3 m -121.41 134.99 55.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.419 1.087 . . . . 0.0 109.45 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.5 p -113.75 133.52 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 C-N-CA 123.291 0.637 . . . . 0.0 111.086 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.9 m -109.42 122.25 46.97 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.674 1.19 . . . . 0.0 109.08 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.6 t -125.92 127.34 71.09 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 124.593 1.157 . . . . 0.0 108.344 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 57.9 mt-10 -116.8 144.89 43.95 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.85 169.28 42.3 Favored Glycine 0 C--O 1.241 0.554 0 C-N-CA 121.464 -0.398 . . . . 0.0 112.366 176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -93.82 146.02 24.18 Favored 'General case' 0 C--N 1.351 0.638 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 -178.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 32.5 tp -133.29 144.64 49.83 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.762 0.825 . . . . 0.0 110.173 -174.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -69.79 172.14 8.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-O 122.275 1.036 . . . . 0.0 112.286 169.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.6 -154.6 24.32 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 113.679 -1.601 . . . . 0.0 109.418 175.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.4 m -90.18 171.56 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 124.281 1.032 . . . . 0.0 110.574 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 75.01 -16.7 0.55 Allowed 'General case' 0 N--CA 1.5 2.065 0 C-N-CA 125.672 1.589 . . . . 0.0 114.394 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.67 150.72 31.22 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.243 1.017 . . . . 0.0 111.216 -168.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -65.08 -41.07 95.38 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -83.21 175.02 10.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.336 0.654 . . . . 0.0 111.61 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -57.76 132.09 52.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 123.892 0.745 . . . . 0.0 111.463 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.9 p80 -153.81 175.53 13.2 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.944 0.898 . . . . 0.0 109.994 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -119.9 170.78 8.94 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.411 1.084 . . . . 0.0 108.25 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.32 70.1 10.79 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.8 t-80 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 125.051 1.34 . . . . 0.0 110.07 178.461 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.4 mmm . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.5 t -128.87 103.86 7.28 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 169.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.41 -173.73 13.1 Favored Glycine 0 C--N 1.354 1.558 0 C-N-CA 122.774 0.226 . . . . 0.0 112.803 -177.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -116.57 150.01 38.71 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.583 0.753 . . . . 0.0 110.229 173.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -107.22 130.71 54.7 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.517 0.727 . . . . 0.0 110.641 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.6 p -117.63 146.05 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 166.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -105.49 124.67 49.94 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 168.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -116.42 117.95 57.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 CA-C-N 113.622 -1.627 . . . . 0.0 108.775 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -102.61 117.0 33.72 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 177.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.2 t -111.07 120.56 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -121.7 118.54 29.37 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.425 1.09 . . . . 0.0 108.224 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 48' ' ' ILE . 18.3 tt -124.21 133.47 69.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.021 0.439 . . . . 0.0 111.443 -178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.1 m -111.26 133.05 53.88 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 174.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.0 t -132.19 102.8 5.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.526 1.13 . . . . 0.0 108.259 -174.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.3 t30 74.02 -65.04 0.37 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 125.201 1.4 . . . . 0.0 110.319 -173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.89 4.09 0.06 OUTLIER Glycine 0 N--CA 1.469 0.882 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -102.79 128.68 49.44 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 124.164 0.986 . . . . 0.0 109.31 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 97.5 m -113.1 129.46 56.5 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.696 0.798 . . . . 0.0 109.628 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -121.57 125.04 45.82 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.443 1.097 . . . . 0.0 108.335 174.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -128.44 141.06 51.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.016 0.526 . . . . 0.0 110.012 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -158.99 139.33 12.29 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.86 0.464 . . . . 0.0 111.376 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.9 m -97.04 131.41 43.87 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.671 1.188 . . . . 0.0 109.515 176.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -122.09 147.45 46.1 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.555 0.742 . . . . 0.0 109.403 -176.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -104.55 121.35 43.31 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 173.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.428 HD22 ' HB3' ' A' ' 36' ' ' LYS . 77.7 mt -114.17 116.21 28.72 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.51 0.724 . . . . 0.0 109.332 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -111.53 111.85 23.16 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.428 1.091 . . . . 0.0 109.002 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.35 152.97 47.59 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.962 0.505 . . . . 0.0 110.409 -169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.6 t -93.65 -44.21 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.507 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -115.17 156.83 24.58 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.847 0.859 . . . . 0.0 111.451 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -60.22 -41.1 92.34 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 124.561 1.145 . . . . 0.0 111.643 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.63 -34.42 78.18 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.45 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -65.56 -42.76 91.48 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.074 0.55 . . . . 0.0 111.092 176.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.52 -38.44 89.68 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -56.25 -54.66 42.7 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.144 0.978 . . . . 0.0 112.438 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -64.16 -32.01 73.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.572 0.749 . . . . 0.0 111.866 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.428 ' HB3' HD22 ' A' ' 25' ' ' LEU . 66.7 mttm -65.09 -42.82 93.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.27 0.628 . . . . 0.0 110.812 174.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.4 mt -62.35 -39.14 92.15 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.545 0.738 . . . . 0.0 110.976 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.9 mtpt -60.7 -43.96 97.13 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.552 0.741 . . . . 0.0 111.338 173.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.13 -45.72 90.65 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.307 0.643 . . . . 0.0 110.635 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.9 -45.69 97.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 124.821 1.248 . . . . 0.0 111.989 176.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 23.2 mt -63.1 -46.82 85.55 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.974 175.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -63.83 -40.05 95.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 118.572 0.623 . . . . 0.0 111.619 177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.19 -48.8 76.85 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.996 0.518 . . . . 0.0 110.283 -176.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -66.3 -29.98 70.3 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.467 0.707 . . . . 0.0 111.36 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mtp -91.68 -3.79 55.9 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.28 0.632 . . . . 0.0 112.226 -176.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -52.05 -52.88 57.82 Favored Pre-proline 0 CA--C 1.566 1.591 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.992 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -71.05 -16.03 32.23 Favored 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 121.772 1.648 . . . . 0.0 112.48 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 12' ' ' ILE . 50.5 mm -81.3 -33.95 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 124.45 1.1 . . . . 0.0 111.495 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -69.6 -33.74 73.12 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -62.53 -23.93 67.23 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.365 1.066 . . . . 0.0 110.903 174.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 90.0 mt -89.94 -37.02 14.66 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.32 48.18 87.23 Favored Glycine 0 C--N 1.351 1.393 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.88 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 74.7 m -70.33 148.25 48.68 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.103 0.561 . . . . 0.0 112.164 -173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -50.7 -40.19 53.37 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 124.288 0.993 . . . . 0.0 110.061 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -157.62 144.83 18.35 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.391 1.076 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.4 m -129.1 151.08 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 124.435 1.094 . . . . 0.0 109.027 -176.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 42.9 ttm180 -127.32 129.46 47.7 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.1 mt -119.86 124.32 72.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.2 m -113.07 129.93 56.34 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 173.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.5 mt -118.26 125.73 74.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.5 ttp85 -112.63 129.12 56.49 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 32.7 t -113.5 134.02 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -93.46 130.75 39.17 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 142.91 27.78 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 87.7 p -82.7 -26.85 31.64 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.216 0.606 . . . . 0.0 111.424 -174.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 8.7 t70 -134.94 127.74 31.18 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.594 0.758 . . . . 0.0 110.303 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -67.39 -29.69 69.27 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.688 0.795 . . . . 0.0 112.46 -175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.36 -51.58 11.62 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.162 0.585 . . . . 0.0 109.527 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.5 mt-10 -70.65 -21.72 62.58 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 114.657 -1.156 . . . . 0.0 112.831 -177.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 10.3 pt-20 -42.03 -32.18 0.43 Allowed 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -64.99 -44.91 87.74 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -69.65 -38.77 77.24 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.392 1.077 . . . . 0.0 110.728 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.69 -36.38 84.08 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.828 0.851 . . . . 0.0 112.158 -177.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.26 -45.0 90.01 Favored 'General case' 0 N--CA 1.48 1.064 0 CA-C-O 120.801 0.334 . . . . 0.0 110.262 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -60.81 -40.56 93.15 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.108 0.963 . . . . 0.0 111.453 174.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.28 -46.58 88.12 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.65 0.78 . . . . 0.0 109.764 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -69.9 -31.13 68.76 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.03 178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.1 -45.95 79.25 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.26 -47.32 71.08 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.522 0.729 . . . . 0.0 111.363 176.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.2 mm -61.11 -53.94 42.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.601 1.16 . . . . 0.0 111.805 -177.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.14 -34.69 78.1 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.202 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -60.29 -41.43 93.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 123.382 0.427 . . . . 0.0 109.867 176.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -69.59 -40.89 76.43 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.037 0.535 . . . . 0.0 110.208 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.8 t -63.0 -51.66 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.022 0.929 . . . . 0.0 110.613 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.93 -35.96 82.83 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.607 0.763 . . . . 0.0 110.689 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.47 71.57 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.65 0.78 . . . . 0.0 111.527 175.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -82.21 -16.35 49.94 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.569 0.748 . . . . 0.0 111.575 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.6 mt -101.65 -12.4 18.45 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -172.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 115.91 5.89 17.25 Favored Glycine 0 C--N 1.348 1.209 0 C-N-CA 123.357 0.503 . . . . 0.0 113.037 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -89.85 143.54 26.7 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.368 0.667 . . . . 0.0 110.971 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -96.63 163.39 13.04 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.383 0.673 . . . . 0.0 110.15 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -55.86 -34.02 65.07 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.876 0.871 . . . . 0.0 110.941 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -74.66 -3.63 32.45 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.913 0.885 . . . . 0.0 112.635 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.4 m120 -94.22 -14.27 25.73 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.731 0.812 . . . . 0.0 110.716 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.6 t -108.49 124.0 64.59 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 C-N-CA 124.655 1.182 . . . . 0.0 110.801 -168.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.7 m -126.27 118.84 25.95 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.607 0.763 . . . . 0.0 110.336 173.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.5 m95 -91.53 132.12 36.49 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.35 0.66 . . . . 0.0 111.694 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.29 91.71 2.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.661 1.184 . . . . 0.0 107.875 170.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.46 -124.24 26.8 Favored Glycine 0 C--N 1.345 1.08 0 CA-C-N 114.915 -1.039 . . . . 0.0 112.529 178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 p30 -85.32 2.4 44.29 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.943 0.897 . . . . 0.0 111.396 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.3 m -125.92 129.53 49.47 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.1 p -117.23 134.44 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 C-N-CA 123.218 0.607 . . . . 0.0 110.066 178.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 66.2 m -109.65 119.97 41.03 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.8 t -125.17 119.31 55.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 87.4 tt0 -125.46 137.34 53.97 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -171.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -175.46 -177.26 44.38 Favored Glycine 0 CA--C 1.502 -0.743 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -101.37 148.6 24.96 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 81.5 mt -59.38 133.95 56.57 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 123.661 0.601 . . . . 0.0 110.051 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -76.33 -29.9 57.45 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.412 1.085 . . . . 0.0 110.673 -178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.44 165.61 13.11 Favored Glycine 0 C--N 1.341 0.818 0 N-CA-C 110.454 -1.058 . . . . 0.0 110.454 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 78.6 t -67.93 -39.66 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -143.7 144.38 31.83 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 114.389 -1.278 . . . . 0.0 108.073 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.7 mt -103.68 176.22 5.22 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.111 0.564 . . . . 0.0 111.383 -172.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -41.14 -44.1 2.45 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.391 0.676 . . . . 0.0 109.792 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -82.95 71.91 10.05 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -64.82 99.61 0.35 Allowed 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.003 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -137.32 44.66 2.25 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.397 1.079 . . . . 0.0 109.511 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -55.77 138.1 48.52 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.137 0.575 . . . . 0.0 110.684 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -67.11 -22.14 65.82 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -170.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.248 0.982 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 176.261 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.1 mmm . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 120.378 0.132 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.7 p -133.27 20.88 4.02 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.339 0.656 . . . . 0.0 110.012 -178.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 110.61 114.99 3.58 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -131.07 130.65 43.49 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.699 0.799 . . . . 0.0 110.735 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -108.34 126.08 52.45 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 176.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -135.39 143.78 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.955 0.902 . . . . 0.0 109.222 177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 45.7 mt-10 -108.63 128.98 55.32 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.8 t -121.97 122.22 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 124.48 1.112 . . . . 0.0 109.999 -175.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.69 119.8 36.92 Favored 'General case' 0 C--N 1.347 0.46 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 175.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.8 t -112.09 122.79 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -124.75 115.8 21.3 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.4 tt -127.97 132.52 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 122.822 0.449 . . . . 0.0 110.588 -175.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 97.7 m -113.88 127.13 55.85 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.86 0.864 . . . . 0.0 109.626 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.7 t -149.36 135.41 18.96 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.227 1.011 . . . . 0.0 109.53 174.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.2 t30 59.51 33.06 22.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.852 1.261 . . . . 0.0 110.994 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.14 2.98 74.46 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.544 -0.753 . . . . 0.0 113.216 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -106.65 128.0 53.81 Favored 'General case' 0 C--N 1.347 0.484 0 C-N-CA 123.937 0.895 . . . . 0.0 110.248 -179.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.8 m -108.24 126.72 53.13 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 -176.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -118.21 126.36 52.03 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -136.11 143.8 44.77 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.057 0.543 . . . . 0.0 109.756 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -157.58 137.97 12.82 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.2 m -98.26 131.77 44.31 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.635 0.774 . . . . 0.0 109.796 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -116.59 141.55 48.05 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.228 1.011 . . . . 0.0 110.472 -175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.444 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -100.03 115.67 30.29 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 173.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.7 mt -116.12 117.26 29.58 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.695 1.198 . . . . 0.0 108.935 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -117.31 128.18 54.8 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.756 0.422 . . . . 0.0 109.998 170.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.44 147.11 27.86 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.398 0.679 . . . . 0.0 110.616 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.8 -54.79 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 123.905 0.882 . . . . 0.0 109.584 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -102.11 152.16 21.32 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.016 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -58.29 -37.57 75.27 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.711 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -62.02 -36.93 83.04 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.232 1.013 . . . . 0.0 111.203 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -68.09 -36.29 79.55 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.059 -178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.52 -39.8 88.81 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.175 0.59 . . . . 0.0 110.714 176.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -56.1 -49.85 72.7 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.93 0.492 . . . . 0.0 111.15 -174.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -65.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.119 -178.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -66.77 -41.29 87.94 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.24 0.616 . . . . 0.0 110.823 175.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.5 mt -63.95 -37.66 88.22 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.662 0.601 . . . . 0.0 110.757 176.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -58.76 -43.27 90.26 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.106 0.562 . . . . 0.0 111.447 171.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.04 -46.17 85.64 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.7 t -57.58 -46.99 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.783 1.233 . . . . 0.0 111.758 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.3 mt -62.91 -44.1 97.0 Favored 'General case' 0 C--O 1.215 -0.737 0 C-N-CA 123.29 0.636 . . . . 0.0 111.689 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -41.8 95.15 Favored 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.89 -46.46 71.57 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.333 0.587 . . . . 0.0 110.658 -176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -64.34 -33.79 76.64 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 114.693 -1.139 . . . . 0.0 111.318 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -88.23 -5.09 58.58 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.0 m-20 -56.24 -52.33 73.79 Favored Pre-proline 0 CA--C 1.56 1.333 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.595 176.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.38 -17.9 26.77 Favored 'Trans proline' 0 C--N 1.389 2.662 0 C-N-CA 121.433 1.422 . . . . 0.0 111.886 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 50.3 mm -76.21 -37.24 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 124.394 1.078 . . . . 0.0 110.301 -177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -65.82 -33.4 75.77 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.93 -24.61 67.8 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.143 0.977 . . . . 0.0 111.008 175.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.7 mt -87.6 -32.04 19.52 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 110.153 -0.314 . . . . 0.0 110.153 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.408 ' CA ' HG13 ' A' ' 111' ' ' VAL . . . 70.45 61.44 4.17 Favored Glycine 0 C--N 1.348 1.214 0 O-C-N 124.017 0.823 . . . . 0.0 113.493 168.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 66.9 m -89.84 129.1 36.26 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.691 0.396 . . . . 0.0 111.278 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.93 -15.19 63.42 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.471 1.108 . . . . 0.0 110.253 172.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -154.52 132.4 11.56 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 174.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -126.44 152.33 33.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 124.098 0.959 . . . . 0.0 109.259 -177.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -115.56 125.81 53.45 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.65 127.78 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 t -121.01 120.28 34.93 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.1 mt -118.95 120.64 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.212 0.605 . . . . 0.0 111.041 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -110.16 130.03 55.61 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 176.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.76 139.55 29.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 -175.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -88.48 129.62 35.4 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -104.66 135.79 45.4 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.717 0.635 . . . . 0.0 110.916 174.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.6 m -69.33 -58.47 3.97 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.943 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 21.0 t0 -90.93 170.0 10.43 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.299 0.64 . . . . 0.0 111.282 -179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -99.56 -32.37 11.13 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.075 0.95 . . . . 0.0 111.081 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.1 -51.36 12.4 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.12 0.568 . . . . 0.0 111.17 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 98.2 mt-10 -68.17 -27.59 66.54 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.077 1.351 . . . . 0.0 112.448 -173.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -49.54 -31.86 11.23 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.345 1.058 . . . . 0.0 113.686 -171.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.91 -46.01 83.49 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 109.53 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.91 -40.02 79.34 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.27 1.028 . . . . 0.0 110.123 178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -65.48 -35.52 81.15 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.916 0.886 . . . . 0.0 111.888 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.63 96.42 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.038 0.535 . . . . 0.0 110.289 174.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -61.91 -40.96 97.28 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 123.902 0.751 . . . . 0.0 111.969 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -63.24 -49.48 73.98 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.67 0.788 . . . . 0.0 109.367 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.16 -30.39 67.53 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.96 -174.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.89 -44.39 82.27 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.97 0.908 . . . . 0.0 110.659 174.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.02 -40.04 94.29 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.834 0.709 . . . . 0.0 110.363 176.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -60.67 -54.83 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.071 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 41.6 mt -68.37 -34.56 76.27 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.18 0.592 . . . . 0.0 110.056 -179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -57.17 -43.71 82.85 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.999 0.812 . . . . 0.0 110.701 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.4 tptt -69.46 -42.52 74.79 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 124.079 0.862 . . . . 0.0 110.998 176.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.4 -52.4 60.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.539 0.735 . . . . 0.0 110.942 -177.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 28.8 m-85 -67.52 -35.11 78.46 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 124.018 0.824 . . . . 0.0 111.226 -178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.78 -32.96 74.63 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.086 0.555 . . . . 0.0 111.718 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -80.49 -16.61 53.88 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.756 0.822 . . . . 0.0 111.791 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -101.79 -9.65 20.61 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.378 0.671 . . . . 0.0 110.557 -172.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.24 15.22 10.76 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 116.086 -0.506 . . . . 0.0 113.627 172.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 92.0 m-85 -99.1 140.08 33.79 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 175.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -94.56 167.2 11.63 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.414 1.086 . . . . 0.0 109.633 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -56.39 -33.89 66.19 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.149 0.979 . . . . 0.0 111.445 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 97.1 p -75.02 -4.02 35.91 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.096 0.958 . . . . 0.0 112.541 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 27.0 m120 -97.66 -17.72 19.3 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.304 0.642 . . . . 0.0 110.699 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 64.1 t -113.21 121.54 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.011 0.924 . . . . 0.0 110.41 -171.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.3 m -126.92 122.56 34.95 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.985 0.914 . . . . 0.0 109.565 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -91.92 133.95 35.22 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.475 0.655 . . . . 0.0 111.8 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -133.04 93.56 3.2 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.932 1.293 . . . . 0.0 107.563 170.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.35 -123.89 26.39 Favored Glycine 0 C--N 1.344 1.011 0 CA-C-N 114.928 -1.033 . . . . 0.0 113.64 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -85.55 2.8 43.39 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.676 0.791 . . . . 0.0 111.984 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.2 m -125.27 131.01 53.16 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.529 0.731 . . . . 0.0 110.269 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.4 p -113.41 135.99 51.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 177.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.91 121.42 44.73 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.693 1.197 . . . . 0.0 108.282 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.4 t -123.41 124.79 70.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -175.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -129.7 144.32 51.23 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 122.732 0.413 . . . . 0.0 110.065 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 170.86 -177.79 43.7 Favored Glycine 0 C--O 1.241 0.58 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -76.34 140.72 41.57 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.626 0.771 . . . . 0.0 112.24 178.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.26 122.45 20.27 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -89.43 109.41 20.33 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 172.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 117.81 31.89 1.53 Allowed Glycine 0 C--N 1.338 0.687 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.22 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.408 HG13 ' CA ' ' A' ' 52' ' ' GLY . 74.6 t -61.99 110.11 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 48.51 54.4 10.56 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 124.781 1.232 . . . . 0.0 112.071 169.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 76.0 mt -97.87 165.52 11.89 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.999 0.519 . . . . 0.0 110.109 175.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -56.85 144.07 34.73 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.546 0.738 . . . . 0.0 110.873 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 74.86 12.17 3.61 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.502 1.521 . . . . 0.0 113.834 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -99.25 -28.57 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 175.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -99.97 81.94 2.5 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 -179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -79.32 140.02 37.64 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.386 -1.279 . . . . 0.0 111.428 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -124.98 29.0 6.26 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.696 0.798 . . . . 0.0 110.056 -178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.18 0 C-N-CA 124.333 1.053 . . . . 0.0 109.787 -176.524 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mmm . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.92 0.39 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.7 t -84.08 106.91 16.1 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.852 0.861 . . . . 0.0 109.907 168.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.04 -0.93 79.66 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.781 -0.927 . . . . 0.0 110.781 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.59 158.58 43.64 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 123.53 0.732 . . . . 0.0 110.546 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -94.79 132.89 39.08 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -126.41 143.18 40.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 124.657 1.183 . . . . 0.0 108.096 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 53.8 mt-10 -105.39 133.17 50.58 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 170.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 94.2 t -117.23 120.68 65.71 Favored 'Isoleucine or valine' 0 C--N 1.345 0.398 0 C-N-CA 125.086 1.355 . . . . 0.0 107.916 -178.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -106.98 119.4 39.26 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.2 t -111.42 118.43 57.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.204 1.002 . . . . 0.0 109.7 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -124.02 114.24 19.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 -176.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.5 tt -126.18 133.68 68.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 123.395 0.678 . . . . 0.0 110.26 -173.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 100.0 m -104.41 126.87 51.89 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 26.1 t -136.45 116.86 13.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.33 1.052 . . . . 0.0 109.149 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.53 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 44.3 t30 63.55 25.35 14.36 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.373 1.469 . . . . 0.0 112.295 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 91.59 -0.27 73.79 Favored Glycine 0 C--N 1.35 1.342 0 CA-C-O 119.863 -0.409 . . . . 0.0 113.407 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -112.02 133.48 54.17 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.448 0.699 . . . . 0.0 110.203 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 90.0 m -99.25 127.29 45.22 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.658 0.783 . . . . 0.0 109.998 -171.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -120.31 123.81 44.05 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.435 1.094 . . . . 0.0 109.034 178.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -128.75 144.71 51.23 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-N 118.357 0.526 . . . . 0.0 110.521 -177.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -151.87 136.91 17.32 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.315 0.646 . . . . 0.0 110.095 177.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.0 m -100.39 131.68 46.18 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.546 0.738 . . . . 0.0 110.024 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -118.6 140.91 49.15 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.096 0.958 . . . . 0.0 108.769 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -101.05 120.18 39.82 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.3 mt -114.72 142.72 46.12 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.101 0.96 . . . . 0.0 109.901 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -143.34 128.08 18.22 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.811 0.844 . . . . 0.0 108.757 170.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.81 156.73 45.55 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.633 0.373 . . . . 0.0 111.192 -178.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.9 t -92.84 -47.15 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 O-C-N 124.506 1.128 . . . . 0.0 109.897 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -106.41 152.33 23.75 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.199 -178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -58.72 -40.22 83.12 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.465 0.706 . . . . 0.0 109.998 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.7 tp10 -65.27 -34.73 79.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.395 1.078 . . . . 0.0 111.408 -178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -64.82 -43.51 92.88 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.702 177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' O ' HD13 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -65.88 -38.59 89.19 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.689 0.395 . . . . 0.0 110.533 177.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.3 mtpt -56.05 -52.72 63.26 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.206 1.002 . . . . 0.0 112.832 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -65.93 -31.08 71.8 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.403 1.081 . . . . 0.0 112.152 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -67.17 -39.96 86.55 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.7 0.8 . . . . 0.0 110.842 175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.4 mt -64.27 -38.82 92.4 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.43 0.692 . . . . 0.0 111.233 172.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -59.45 -42.22 91.46 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.123 0.569 . . . . 0.0 110.706 173.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.83 -44.42 89.9 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.652 0.595 . . . . 0.0 111.42 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.9 t -57.26 -46.57 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.134 0.974 . . . . 0.0 112.156 175.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.25 -48.79 72.04 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 123.543 0.527 . . . . 0.0 111.312 177.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -61.05 -40.96 95.62 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.983 0.513 . . . . 0.0 111.988 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.04 -41.38 97.42 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.623 0.369 . . . . 0.0 110.054 178.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.8 tpm_? -64.83 -40.75 95.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.541 0.736 . . . . 0.0 111.096 176.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.9 mmm -86.09 -14.64 43.69 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -169.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.33 -56.34 36.29 Favored Pre-proline 0 CA--C 1.561 1.377 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.439 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.89 -22.96 30.77 Favored 'Trans proline' 0 C--N 1.395 3.017 0 C-N-CA 122.045 1.83 . . . . 0.0 112.718 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 33.4 mm -67.08 -36.11 76.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.349 0 C-N-CA 124.281 1.033 . . . . 0.0 111.507 -177.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -72.81 -38.26 67.24 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.422 0.689 . . . . 0.0 110.168 176.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -59.09 -31.45 68.91 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.205 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.3 mt -76.15 -32.2 58.96 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.164 0.586 . . . . 0.0 110.789 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.23 53.94 8.48 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 124.014 0.821 . . . . 0.0 112.18 165.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.53 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 15.0 m -90.25 154.29 19.84 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.274 0.63 . . . . 0.0 110.74 174.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -61.52 -69.62 0.23 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.536 0.734 . . . . 0.0 110.156 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -129.33 154.14 47.17 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 123.961 0.905 . . . . 0.0 108.603 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -131.38 152.19 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 123.166 0.587 . . . . 0.0 109.708 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -117.71 126.09 51.85 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 74.0 mt -117.21 129.62 73.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.9 t -112.92 124.69 53.2 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 175.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.9 mp -115.0 117.93 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.397 0.679 . . . . 0.0 109.579 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 56.2 ttp180 -116.16 131.94 56.8 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -108.21 139.2 31.35 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 -173.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -90.49 130.86 36.5 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -101.26 145.58 28.66 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.009 0.924 . . . . 0.0 110.464 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -57.33 -45.29 84.43 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.71 0.804 . . . . 0.0 111.044 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -159.46 168.59 25.85 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.763 0.825 . . . . 0.0 108.897 -175.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.46 -48.55 78.89 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.334 1.054 . . . . 0.0 113.228 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.35 -35.04 79.34 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.086 0.554 . . . . 0.0 110.648 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -67.37 -28.59 68.08 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.539 -175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -48.55 -47.76 39.17 Favored 'General case' 0 N--CA 1.501 2.096 0 C-N-CA 126.061 1.745 . . . . 0.0 115.412 -171.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.12 -48.13 77.27 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.796 0.838 . . . . 0.0 110.744 -174.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.77 -43.09 72.91 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.103 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -71.48 -35.9 70.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.504 1.121 . . . . 0.0 110.233 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.24 77.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.12 176.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.84 -47.88 81.39 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.429 1.091 . . . . 0.0 111.552 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -63.7 -51.34 65.48 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.303 1.441 . . . . 0.0 110.569 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -70.08 -31.98 69.83 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.317 -176.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -59.09 -43.0 91.77 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.589 0.755 . . . . 0.0 110.822 176.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.57 -41.44 97.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.484 0.713 . . . . 0.0 110.814 175.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.4 mm -61.88 -50.76 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.769 178.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.22 -44.21 84.44 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.479 0.711 . . . . 0.0 109.545 -176.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -61.04 -39.93 91.69 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.712 1.205 . . . . 0.0 111.319 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.26 -42.82 87.99 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.319 174.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 45.3 t -62.25 -44.96 99.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.378 0.671 . . . . 0.0 110.393 178.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -62.55 -45.98 90.46 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.587 -178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.18 74.45 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.19 0.596 . . . . 0.0 111.944 177.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -78.19 -18.36 55.6 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.628 0.771 . . . . 0.0 111.006 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 81.0 mt -97.27 -10.12 26.32 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.955 0.502 . . . . 0.0 110.886 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.53 25.87 10.49 Favored Glycine 0 C--N 1.35 1.341 0 C-N-CA 123.125 0.393 . . . . 0.0 114.02 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 80.1 m-85 -92.81 140.52 29.43 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -81.7 149.76 28.32 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.441 0.697 . . . . 0.0 110.073 -179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -57.29 -35.23 69.55 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.424 1.09 . . . . 0.0 111.57 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.7 m -69.3 -41.97 76.07 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.48 1.112 . . . . 0.0 111.71 176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -64.93 -16.24 63.08 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.215 1.006 . . . . 0.0 111.937 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 84.4 t -103.4 118.68 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.263 1.025 . . . . 0.0 109.174 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.7 m -122.68 119.55 31.06 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.638 0.775 . . . . 0.0 109.996 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 50.5 m95 -91.61 131.74 36.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.707 0.403 . . . . 0.0 110.226 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -135.9 92.69 2.84 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 171.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.68 -126.13 17.74 Favored Glycine 0 C--N 1.342 0.861 0 O-C-N 123.64 0.588 . . . . 0.0 112.435 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.2 p-10 -88.63 3.28 51.12 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.653 1.181 . . . . 0.0 110.355 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 74.2 m -126.73 130.83 51.12 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.933 0.893 . . . . 0.0 110.128 -174.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.9 p -115.77 134.62 58.47 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.253 0.549 . . . . 0.0 110.013 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.6 m -107.24 119.2 38.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.532 1.533 . . . . 0.0 108.222 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.2 t -120.58 129.54 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -114.22 143.22 45.19 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -153.69 170.46 32.42 Favored Glycine 0 C--N 1.333 0.396 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -114.4 139.46 49.47 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 55.1 mt -83.82 148.69 26.86 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.487 0.661 . . . . 0.0 111.925 -172.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -70.94 -43.26 68.54 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 114.219 -1.355 . . . . 0.0 110.053 173.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.47 -173.96 50.85 Favored Glycine 0 C--N 1.357 1.736 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.655 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 96.1 t 81.33 -55.0 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 126.002 1.721 . . . . 0.0 112.478 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -53.42 111.15 0.65 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.363 1.865 . . . . 0.0 112.33 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.7 mt -107.02 150.79 26.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.766 1.226 . . . . 0.0 108.534 177.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -85.13 145.28 27.71 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -111.64 24.85 12.27 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -84.99 146.2 27.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.434 0.694 . . . . 0.0 110.008 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.7 39.83 3.31 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -72.28 -19.39 61.69 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.329 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.61 135.94 57.64 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.934 0.894 . . . . 0.0 110.462 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 . . . . . 0 C--O 1.246 0.908 0 C-N-CA 124.581 1.152 . . . . 0.0 108.934 -179.633 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.488 ' H ' HG23 ' A' ' 28' ' ' VAL . 99.8 p -150.74 7.27 0.55 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.46 0.704 . . . . 0.0 110.968 162.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.67 -89.65 1.49 Allowed Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 -167.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -122.78 165.11 17.13 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.747 0.819 . . . . 0.0 111.497 -168.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -120.91 140.08 52.32 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 -176.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.9 p -135.07 144.41 34.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 CA-C-N 114.053 -1.431 . . . . 0.0 107.518 168.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 94.3 mt-10 -106.77 136.26 46.89 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 174.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.6 t -119.72 115.28 47.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 125.663 1.585 . . . . 0.0 108.996 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -103.28 116.33 32.24 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.85 119.74 60.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 C-N-CA 123.546 0.739 . . . . 0.0 109.478 -172.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -116.58 119.56 35.92 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.9 tt -128.0 135.03 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-O 121.15 0.5 . . . . 0.0 110.903 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.5 m -107.82 128.49 54.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.7 t -144.97 117.71 8.69 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.86 1.264 . . . . 0.0 109.463 -175.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 64.91 22.88 12.55 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.012 1.325 . . . . 0.0 112.114 -175.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.13 5.1 83.52 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 115.72 -0.673 . . . . 0.0 113.448 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -110.12 132.88 53.77 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.322 1.049 . . . . 0.0 108.998 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 64.2 m -101.69 127.94 48.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.134 0.573 . . . . 0.0 110.06 -174.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -114.99 118.62 33.93 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 173.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -133.51 132.39 40.94 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.994 -0.441 . . . . 0.0 110.418 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -152.67 141.48 21.05 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.044 -177.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 96.9 m -93.93 128.99 40.54 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.594 1.157 . . . . 0.0 110.141 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -115.29 144.9 43.05 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.985 0.914 . . . . 0.0 110.368 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.442 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 78.0 mt-30 -103.11 118.63 37.22 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 173.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.6 mt -111.27 111.56 22.71 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.629 0.771 . . . . 0.0 109.861 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -103.92 121.15 42.51 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.579 0.752 . . . . 0.0 109.203 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -149.16 159.85 43.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.615 0.766 . . . . 0.0 110.045 -169.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.488 HG23 ' H ' ' A' ' 2' ' ' SER . 69.5 t -102.16 -54.2 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 172.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -100.01 155.33 17.76 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.512 -174.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -60.24 -42.23 94.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.883 0.873 . . . . 0.0 110.724 177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -64.91 -33.71 76.68 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.523 0.729 . . . . 0.0 110.843 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -65.01 -39.74 93.88 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.73 -39.33 80.44 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 122.902 0.481 . . . . 0.0 110.267 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -54.7 -51.5 65.37 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.873 0.869 . . . . 0.0 111.934 -175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -64.65 -33.19 75.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.122 0.889 . . . . 0.0 111.395 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -66.24 -39.8 89.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.282 0.633 . . . . 0.0 111.19 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.7 mt -62.3 -41.8 98.83 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 123.74 0.65 . . . . 0.0 110.732 174.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.41 -43.9 92.93 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.824 0.45 . . . . 0.0 110.969 174.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -48.9 75.65 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.426 0.454 . . . . 0.0 110.232 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.38 -45.5 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 C-N-CA 124.54 1.136 . . . . 0.0 111.599 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.74 -46.25 86.18 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.915 176.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -64.28 -42.49 96.4 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 118.513 0.597 . . . . 0.0 111.837 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -67.95 -43.18 79.68 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -176.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -67.89 -40.08 83.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.515 177.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 93.0 mtp -89.44 -6.5 56.45 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.024 0.53 . . . . 0.0 111.183 -175.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.98 -51.65 80.02 Favored Pre-proline 0 CA--C 1.565 1.553 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -73.45 -18.6 22.77 Favored 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 121.749 1.633 . . . . 0.0 112.287 175.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.434 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.7 mm -68.83 -34.84 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.013 0 C-N-CA 124.482 1.113 . . . . 0.0 110.77 -177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' HA ' HD21 ' A' ' 108' ' ' LEU . 99.2 mttt -68.98 -36.56 78.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.292 0.637 . . . . 0.0 110.074 175.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -64.9 -29.03 69.95 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 124.374 1.07 . . . . 0.0 109.522 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.3 mt -77.8 -31.78 51.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.84 -2.04 81.62 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.285 -0.871 . . . . 0.0 114.04 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 p -42.32 110.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -51.12 -54.9 20.87 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.083 0.953 . . . . 0.0 110.855 -176.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.8 ttp-105 -113.47 143.76 43.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.4 m -130.89 150.3 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.381 0.672 . . . . 0.0 109.499 -176.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -123.52 128.24 49.48 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 85.2 mt -124.51 123.84 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.3 m -112.31 127.76 56.08 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 174.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -120.9 125.02 73.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 123.628 0.771 . . . . 0.0 109.348 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -112.35 128.1 56.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -109.44 142.19 22.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.595 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 -175.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -89.48 126.29 35.52 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -99.38 136.99 38.51 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 124.122 0.969 . . . . 0.0 109.119 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.7 p -78.52 -18.98 53.94 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.209 1.004 . . . . 0.0 112.8 -177.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.2 t0 -153.71 119.82 5.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.068 0.547 . . . . 0.0 109.722 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.08 -26.2 36.22 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.95 -48.99 31.92 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.734 0.413 . . . . 0.0 110.772 172.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -74.37 -21.43 59.67 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.068 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -50.44 -29.27 9.89 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -169.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -66.61 -46.16 76.77 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.781 0.801 . . . . 0.0 109.159 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -68.78 -39.17 80.31 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.457 1.503 . . . . 0.0 110.827 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -69.79 -36.41 75.67 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.769 0.827 . . . . 0.0 110.423 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.15 -47.35 74.33 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.584 0.553 . . . . 0.0 111.549 174.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -56.2 -44.5 79.53 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 124.344 1.027 . . . . 0.0 109.295 175.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.27 -50.69 69.12 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.841 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -68.1 -29.01 67.84 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.318 1.047 . . . . 0.0 110.067 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.21 -42.88 92.0 Favored 'General case' 0 C--N 1.346 0.433 0 C-N-CA 123.42 0.688 . . . . 0.0 110.66 175.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.85 -41.0 88.07 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.771 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm -56.19 -54.12 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.873 0.869 . . . . 0.0 110.209 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 60.1 mt -67.85 -33.24 74.37 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.664 0.785 . . . . 0.0 111.635 179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -56.38 -42.5 77.98 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.008 0.523 . . . . 0.0 110.086 178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -72.66 -39.57 67.04 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.975 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 52.3 t -65.41 -55.17 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.397 0.679 . . . . 0.0 110.273 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -65.54 -35.69 81.59 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 124.151 0.98 . . . . 0.0 112.301 -175.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.65 -29.85 70.86 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.17 0.588 . . . . 0.0 111.36 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -84.09 -12.47 55.01 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.026 0.93 . . . . 0.0 111.707 178.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.2 mt -106.88 -10.24 16.07 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.162 0.585 . . . . 0.0 110.698 -171.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 111.47 15.29 10.51 Favored Glycine 0 C--N 1.345 1.082 0 CA-C-O 119.955 -0.358 . . . . 0.0 112.96 173.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -99.92 137.46 38.35 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.77 0.428 . . . . 0.0 110.047 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -85.77 157.45 20.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.731 0.812 . . . . 0.0 109.837 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -53.73 -44.47 69.93 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.984 0.914 . . . . 0.0 111.659 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.6 p -64.18 -23.47 67.33 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.312 1.045 . . . . 0.0 112.949 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -72.14 -12.87 61.39 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.713 0.405 . . . . 0.0 111.643 177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -105.87 121.63 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 123.977 0.911 . . . . 0.0 110.398 -176.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.1 m -126.87 118.48 24.67 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.516 0.726 . . . . 0.0 110.677 176.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 42.2 m95 -90.08 132.08 35.6 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.464 0.706 . . . . 0.0 111.35 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -133.07 93.62 3.21 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 169.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.01 -123.79 15.65 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.084 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.33 1.2 55.13 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.8 0.84 . . . . 0.0 111.346 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.9 m -125.71 131.07 52.64 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.903 0.881 . . . . 0.0 109.61 -174.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.9 p -115.13 134.83 56.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.957 0.903 . . . . 0.0 108.585 178.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.7 m -110.51 123.03 49.16 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 65.8 t -125.0 120.58 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -131.48 134.09 45.81 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -175.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -172.18 171.42 44.21 Favored Glycine 0 C--N 1.341 0.842 0 O-C-N 123.534 0.521 . . . . 0.0 112.474 -176.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -76.26 134.14 39.88 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 122.607 0.363 . . . . 0.0 110.076 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 49' ' ' LYS . 55.1 tp -81.27 127.53 32.81 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 58.33 20.95 7.76 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.675 1.19 . . . . 0.0 111.687 -174.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.56 64.0 Favored Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 -178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -105.84 -0.54 10.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 123.187 0.595 . . . . 0.0 111.522 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -155.39 67.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.931 0.893 . . . . 0.0 108.644 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.5 mt -83.56 -37.95 22.32 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.003 177.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -80.0 110.42 15.37 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.346 0.658 . . . . 0.0 112.637 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -114.77 -10.48 12.4 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.914 0.886 . . . . 0.0 110.676 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -85.0 -65.0 1.06 Allowed 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -87.51 64.79 8.31 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -144.16 89.93 2.07 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.124 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -125.02 44.98 2.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.139 0.975 . . . . 0.0 109.666 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 . . . . . 0 C--O 1.254 1.295 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 -176.956 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' O ' ' C ' ' A' ' 2' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.426 ' C ' ' O ' ' A' ' 1' ' ' MET . 70.5 m -40.19 128.94 2.3 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 -163.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -94.17 -151.22 27.95 Favored Glycine 0 C--N 1.339 0.703 0 N-CA-C 110.213 -1.155 . . . . 0.0 110.213 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -102.15 153.43 19.95 Favored 'General case' 0 C--O 1.246 0.91 0 C-N-CA 123.6 0.76 . . . . 0.0 110.604 -178.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -83.1 130.33 35.11 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 178.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -127.59 140.06 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.368 1.067 . . . . 0.0 108.449 174.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -107.18 138.29 43.64 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 91.9 t -117.4 117.87 56.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 114.007 -1.452 . . . . 0.0 108.326 -178.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -103.96 114.56 28.89 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.8 t -112.22 119.24 59.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -118.47 118.38 31.58 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.8 tt -128.76 134.03 65.2 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 123.352 0.661 . . . . 0.0 110.328 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.5 m -103.88 129.46 51.38 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.2 t -149.82 132.78 16.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.904 0.882 . . . . 0.0 108.948 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 61.75 22.09 12.71 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 126.405 1.882 . . . . 0.0 112.571 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.33 2.24 85.51 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 119.825 -0.431 . . . . 0.0 112.578 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -108.18 140.56 41.23 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.107 0.563 . . . . 0.0 109.678 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.3 m -91.81 123.34 35.11 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 -178.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -116.58 111.54 20.05 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -135.95 138.49 42.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.834 0.454 . . . . 0.0 111.007 -177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -149.66 138.82 21.26 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 115.319 -0.855 . . . . 0.0 108.902 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.1 m -98.99 130.92 45.36 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.453 1.101 . . . . 0.0 108.295 176.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -116.59 140.49 49.33 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.13 0.972 . . . . 0.0 110.029 -178.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -101.58 119.74 39.24 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 79.1 mt -114.17 121.12 42.78 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.99 0.916 . . . . 0.0 109.107 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -123.96 120.86 33.71 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -130.39 160.41 34.09 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.675 0.79 . . . . 0.0 109.357 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 77.2 t -98.84 -43.48 11.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.1 mtm180 -114.23 154.67 27.51 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.375 0.607 . . . . 0.0 110.989 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -60.04 -37.77 80.78 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.022 173.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -63.37 -36.89 85.22 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.589 0.756 . . . . 0.0 111.64 175.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -67.41 -42.96 82.38 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.708 0.803 . . . . 0.0 110.898 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -63.08 -40.1 96.67 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.555 0.742 . . . . 0.0 110.922 175.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -58.88 -49.86 76.18 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.744 0.817 . . . . 0.0 112.26 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.1 pt-20 -69.91 -26.93 64.39 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 124.128 0.892 . . . . 0.0 111.927 178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -66.62 -43.97 83.29 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 123.48 0.712 . . . . 0.0 109.857 172.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 77.4 mt -63.79 -36.84 85.23 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.786 0.834 . . . . 0.0 111.477 174.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -60.51 -44.05 96.44 Favored 'General case' 0 C--N 1.357 0.895 0 C-N-CA 122.734 0.414 . . . . 0.0 110.137 173.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.1 -44.34 89.14 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 123.526 0.516 . . . . 0.0 111.665 177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.23 -44.93 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 C-N-CA 123.535 0.734 . . . . 0.0 110.686 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.2 mt -64.0 -46.36 84.88 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.698 0.624 . . . . 0.0 111.434 176.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -60.2 -41.48 93.05 Favored 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.194 0.452 . . . . 0.0 112.062 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -64.3 -39.64 94.33 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.59 0.556 . . . . 0.0 110.777 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -76.6 -32.86 58.36 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.287 0.635 . . . . 0.0 110.939 -178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.8 mmm -92.15 -18.96 22.78 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.007 0.817 . . . . 0.0 112.353 -171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -67.08 -50.52 40.93 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 123.316 0.646 . . . . 0.0 111.507 -175.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.81 -17.39 32.82 Favored 'Trans proline' 0 C--N 1.389 2.697 0 C-N-CA 121.585 1.524 . . . . 0.0 112.336 -178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.4 mm -65.54 -30.91 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 C-N-CA 123.992 0.917 . . . . 0.0 111.508 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.92 -42.08 67.12 Favored 'General case' 0 N--CA 1.478 0.975 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 174.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -60.13 -35.77 75.99 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.8 0.84 . . . . 0.0 109.348 174.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 97.9 mt -74.34 -25.18 59.38 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.86 0.464 . . . . 0.0 110.044 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 81.59 47.0 6.55 Favored Glycine 0 C--N 1.343 0.942 0 CA-C-N 115.641 -0.709 . . . . 0.0 113.919 172.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 96.7 m -98.99 118.03 34.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 122.493 0.317 . . . . 0.0 111.048 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.02 -46.72 88.59 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 126.197 1.799 . . . . 0.0 112.892 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -144.62 138.52 27.45 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.6 m -134.89 157.32 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.451 1.1 . . . . 0.0 109.885 -174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -118.17 129.15 55.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.2 mp -117.9 129.43 74.31 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 125.343 1.457 . . . . 0.0 108.215 -176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.4 m -115.95 123.44 48.06 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.4 mt -122.55 122.22 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.583 0.753 . . . . 0.0 109.373 -175.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -110.6 135.46 51.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.532 0.733 . . . . 0.0 109.574 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -103.53 138.13 29.2 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -92.12 129.39 38.08 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.633 0.373 . . . . 0.0 110.441 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -107.45 140.46 40.37 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.892 0.877 . . . . 0.0 110.594 175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 66.1 m -117.47 19.38 14.01 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.919 0.888 . . . . 0.0 108.992 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -155.37 100.62 2.15 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.58 71.89 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.02 -50.83 37.46 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.264 0.626 . . . . 0.0 110.202 177.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -75.0 -24.4 58.39 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -49.89 -29.37 8.06 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.937 0.718 . . . . 0.0 112.937 -166.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.96 -48.39 74.2 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.084 0.954 . . . . 0.0 110.498 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -73.29 -36.78 66.36 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.445 1.098 . . . . 0.0 109.852 178.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -67.41 -35.79 79.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.963 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.49 -47.9 77.21 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.835 0.454 . . . . 0.0 109.941 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.73 -42.78 93.88 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.607 177.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.03 -50.87 70.3 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.479 -1.237 . . . . 0.0 110.692 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -70.04 -31.73 69.51 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.068 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.489 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -57.3 -42.23 81.34 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 123.832 0.853 . . . . 0.0 110.504 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.28 -39.8 95.6 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.577 173.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 33.3 mm -62.88 -50.06 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.601 0.76 . . . . 0.0 111.236 179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.0 mt -67.92 -43.36 79.35 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.528 0.331 . . . . 0.0 111.511 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -59.34 -36.79 76.33 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.112 0.565 . . . . 0.0 110.092 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.84 -39.82 79.74 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.952 176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.59 -49.05 85.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.737 0.815 . . . . 0.0 111.08 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -39.26 89.99 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.204 0.94 . . . . 0.0 111.629 -176.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.32 -34.02 77.35 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.228 0.611 . . . . 0.0 111.602 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -78.21 -18.87 54.89 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.884 0.873 . . . . 0.0 111.763 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.1 mt -100.67 -7.23 24.08 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.142 0.577 . . . . 0.0 111.259 -175.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.38 21.58 14.67 Favored Glycine 0 C--N 1.347 1.16 0 N-CA-C 114.249 0.46 . . . . 0.0 114.249 176.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -92.65 135.9 33.69 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.281 0.632 . . . . 0.0 110.352 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -76.58 140.91 41.25 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.934 0.893 . . . . 0.0 108.964 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -53.63 -43.12 68.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.597 0.759 . . . . 0.0 111.951 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 87.8 p -62.7 -32.65 73.78 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.074 0.95 . . . . 0.0 111.459 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -69.19 -12.14 61.42 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 122.894 0.478 . . . . 0.0 110.957 176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.74 117.73 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.581 0.752 . . . . 0.0 111.315 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 92.7 m -124.94 120.65 32.21 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.094 0.557 . . . . 0.0 110.087 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.489 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 62.9 m95 -92.29 130.13 38.06 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.547 0.739 . . . . 0.0 112.062 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -140.64 94.36 2.72 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.135 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.86 -121.32 18.99 Favored Glycine 0 C--N 1.351 1.383 0 CA-C-N 114.446 -1.252 . . . . 0.0 114.657 178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -74.56 -15.74 60.84 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 124.818 1.247 . . . . 0.0 111.253 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 90.4 m -120.93 136.25 55.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.094 -168.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.3 p -112.87 131.81 63.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.3 m -109.19 119.85 40.77 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 92.9 t -124.03 132.42 71.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -174.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -106.03 142.45 35.7 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -134.15 153.28 20.88 Favored Glycine 0 C--N 1.343 0.95 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -112.45 132.7 54.92 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 86.7 mt -121.85 155.08 36.13 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.035 0.445 . . . . 0.0 110.569 -175.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -65.53 -29.78 70.45 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 114.399 -1.273 . . . . 0.0 110.554 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 61.97 -148.96 47.66 Favored Glycine 0 C--N 1.355 1.607 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.836 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 111' ' ' VAL . 29.8 m -90.91 68.27 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 57.13 45.45 20.7 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 124.525 1.13 . . . . 0.0 111.435 -174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 87.0 mt -100.65 155.9 17.62 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.232 0.613 . . . . 0.0 110.043 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -127.23 113.56 16.49 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.148 0.579 . . . . 0.0 109.813 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -79.58 95.33 5.84 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.642 0.777 . . . . 0.0 109.739 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -103.48 144.94 30.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.199 1.0 . . . . 0.0 109.729 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -144.96 110.85 5.43 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.809 0.844 . . . . 0.0 108.763 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -89.98 145.34 25.18 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.782 0.833 . . . . 0.0 110.78 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -144.74 -2.71 0.82 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.943 0.897 . . . . 0.0 110.862 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 CA--C 1.556 1.204 0 C-N-CA 122.832 0.453 . . . . 0.0 110.37 -179.197 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HG2' ' HG2' ' A' ' 29' ' ' ARG . 65.6 mtm . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -137.57 113.99 10.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.996 0.918 . . . . 0.0 110.157 172.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -63.31 103.82 0.73 Allowed Glycine 0 C--N 1.354 1.571 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.369 -173.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -120.19 154.33 34.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.156 0.582 . . . . 0.0 109.764 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -103.55 129.96 50.86 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.4 p -124.19 140.3 47.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.647 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -103.07 132.66 49.17 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 175.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.2 t -120.25 119.32 59.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -100.83 119.74 39.11 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.76 120.1 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -119.82 115.95 24.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.4 tt -127.87 133.65 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-O 121.154 0.502 . . . . 0.0 110.65 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.2 m -108.27 132.75 53.36 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 48' ' ' ILE . 41.1 t -137.87 112.92 9.14 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.776 0.831 . . . . 0.0 110.079 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 71.79 -64.78 0.37 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.568 1.547 . . . . 0.0 110.911 -172.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.96 4.99 0.06 OUTLIER Glycine 0 C--N 1.339 0.735 0 O-C-N 123.312 0.383 . . . . 0.0 112.176 176.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -111.59 131.47 55.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.74 0.816 . . . . 0.0 110.633 -176.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 95.6 m -103.6 129.4 50.86 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.178 0.991 . . . . 0.0 109.776 -174.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -120.28 124.6 46.03 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -135.94 142.58 44.63 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 179.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -155.28 141.09 18.12 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.654 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.3 m -95.91 130.86 42.76 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 123.736 0.814 . . . . 0.0 109.167 176.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -118.54 144.15 46.26 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.556 0.743 . . . . 0.0 109.891 -177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -102.04 118.38 36.79 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.5 mt -120.29 113.82 20.95 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.368 0.667 . . . . 0.0 109.804 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -100.82 130.11 46.79 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.692 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -146.02 145.26 30.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.353 0.661 . . . . 0.0 109.409 -176.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 76.7 t -94.86 -40.31 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-O 122.037 0.922 . . . . 0.0 109.431 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.48 ' HG2' ' HG2' ' A' ' 1' ' ' MET . 88.7 mtm180 -106.62 144.17 33.67 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -59.03 -34.6 72.09 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.261 0.624 . . . . 0.0 110.588 175.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.97 -35.15 80.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.577 1.151 . . . . 0.0 112.161 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.81 -36.51 84.58 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 122.416 -0.178 . . . . 0.0 110.536 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.88 -38.94 80.01 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.539 0.736 . . . . 0.0 111.344 177.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -55.02 -51.07 67.43 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.559 0.744 . . . . 0.0 111.902 -174.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.54 -32.61 74.12 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 124.316 1.01 . . . . 0.0 112.426 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -65.91 -42.8 89.73 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 123.144 0.577 . . . . 0.0 110.024 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 81.2 mt -59.85 -43.59 94.57 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.079 0.862 . . . . 0.0 110.969 176.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -60.65 -44.93 95.84 Favored 'General case' 0 C--N 1.357 0.9 0 O-C-N 124.051 0.844 . . . . 0.0 111.119 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.46 -45.22 91.83 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.494 0.496 . . . . 0.0 111.283 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.7 t -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.733 0.813 . . . . 0.0 111.545 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.5 mt -63.64 -47.17 82.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.171 0.588 . . . . 0.0 111.237 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -64.59 -43.8 92.69 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.24 0.616 . . . . 0.0 111.412 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -63.43 -45.55 90.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.43 1.092 . . . . 0.0 111.556 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.4 tpp180 -64.46 -39.48 93.9 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.497 0.498 . . . . 0.0 110.699 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.403 ' HA ' ' CG1' ' A' ' 48' ' ' ILE . 91.7 mtp -86.1 -6.3 59.04 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 -174.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -52.24 -57.08 16.65 Favored Pre-proline 0 CA--C 1.563 1.443 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.572 171.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.89 -22.48 48.73 Favored 'Trans proline' 0 C--N 1.386 2.55 0 C-N-CA 121.684 1.589 . . . . 0.0 113.15 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.403 ' CG1' ' HA ' ' A' ' 45' ' ' MET . 43.7 mm -66.56 -32.06 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 123.56 0.744 . . . . 0.0 110.478 -176.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.26 -43.18 78.37 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.51 0.671 . . . . 0.0 109.272 177.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.61 -31.77 70.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.032 -1.44 . . . . 0.0 111.475 173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.8 mt -78.15 -21.62 49.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.613 0.365 . . . . 0.0 110.754 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 65.75 85.99 0.07 OUTLIER Glycine 0 C--N 1.35 1.323 0 O-C-N 123.691 0.619 . . . . 0.0 113.061 171.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.2 p -135.1 129.1 33.4 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.318 0.647 . . . . 0.0 111.253 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.64 -36.29 80.49 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 124.253 1.021 . . . . 0.0 110.665 -175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -134.06 150.28 51.19 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 171.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -129.74 150.11 34.29 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 124.932 1.293 . . . . 0.0 108.388 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 124.09 48.53 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 173.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 86.0 mt -119.86 121.47 66.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -112.42 128.04 56.2 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.1 mt -119.07 125.21 74.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.685 0.794 . . . . 0.0 109.905 -178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -112.91 128.82 56.58 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.1 p -107.79 137.15 40.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 N-CA-C 106.936 -1.505 . . . . 0.0 106.936 -172.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -97.86 128.86 44.75 Favored 'General case' 0 C--O 1.24 0.581 0 O-C-N 121.316 -0.865 . . . . 0.0 108.901 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -114.8 125.65 53.92 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.41 1.084 . . . . 0.0 108.551 171.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 96.5 p -73.96 -21.66 59.94 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 122.954 0.501 . . . . 0.0 110.403 177.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -90.17 151.4 21.58 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.954 0.902 . . . . 0.0 110.22 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -100.16 -45.51 5.61 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.107 0.963 . . . . 0.0 112.354 -179.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.93 -57.16 4.04 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.09 0.556 . . . . 0.0 111.654 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -67.25 -25.63 66.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.402 1.081 . . . . 0.0 112.668 -173.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -50.7 -29.92 12.46 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 114.136 1.161 . . . . 0.0 114.136 -173.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.19 -47.01 81.41 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.347 0.659 . . . . 0.0 110.963 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -70.27 -38.01 75.0 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 123.776 0.83 . . . . 0.0 109.323 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -69.18 -32.94 72.58 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.408 1.068 . . . . 0.0 111.995 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.53 -45.97 81.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 122.743 0.417 . . . . 0.0 110.52 175.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -60.1 -38.35 82.71 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.2 174.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -67.68 -42.49 82.04 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.325 1.45 . . . . 0.0 111.227 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -71.24 -31.18 67.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.541 0.736 . . . . 0.0 110.788 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.59 -41.74 77.51 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 122.695 0.398 . . . . 0.0 110.385 178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.85 -38.41 90.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.391 0.676 . . . . 0.0 111.291 175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.7 mm -61.38 -50.45 80.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 124.26 1.024 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 43.9 mt -67.68 -38.18 83.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.671 0.788 . . . . 0.0 111.488 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -59.18 -39.29 82.08 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.192 0.597 . . . . 0.0 111.4 176.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -72.96 -36.96 67.24 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 122.55 0.34 . . . . 0.0 111.761 176.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 39.5 t -65.61 -50.48 71.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.46 0.704 . . . . 0.0 110.167 178.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -63.11 -37.9 89.06 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.2 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.74 -29.86 70.86 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.807 0.843 . . . . 0.0 112.354 176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -83.71 -16.79 43.58 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.373 0.669 . . . . 0.0 112.507 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -104.05 -10.52 17.98 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 110.53 17.68 9.08 Favored Glycine 0 N--CA 1.478 1.457 0 N-CA-C 113.866 0.307 . . . . 0.0 113.866 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -104.57 140.94 37.26 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -88.77 157.53 18.46 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 57.0 p-10 -90.24 21.48 3.78 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 121.543 0.687 . . . . 0.0 110.01 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 56.2 m -101.68 -38.79 7.75 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 125.08 1.352 . . . . 0.0 108.174 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -86.74 5.5 36.01 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.916 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.4 t -94.15 114.6 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -175.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.3 m -127.64 121.75 31.27 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.635 0.774 . . . . 0.0 109.658 179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -92.24 130.88 37.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.359 0.663 . . . . 0.0 110.47 176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -126.27 94.49 4.1 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 105.49 -2.041 . . . . 0.0 105.49 170.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.98 -124.05 25.15 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 123.794 0.683 . . . . 0.0 112.065 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -88.1 6.49 36.08 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.812 0.845 . . . . 0.0 111.395 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.6 m -124.81 129.58 50.72 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 123.537 0.735 . . . . 0.0 110.297 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.5 p -116.42 136.54 53.1 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -111.3 123.89 51.12 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.516 0.726 . . . . 0.0 109.163 174.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.4 t -130.71 128.17 62.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 125.299 1.44 . . . . 0.0 108.127 -172.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 58.6 mt-10 -114.47 144.67 42.96 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -179.42 -162.31 28.36 Favored Glycine 0 CA--C 1.508 -0.381 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -143.65 158.14 43.89 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.046 0.538 . . . . 0.0 110.072 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.55 164.77 11.79 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.798 0.839 . . . . 0.0 109.438 -178.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -94.76 112.53 24.26 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 175.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.9 76.21 0.29 Allowed Glycine 0 C--N 1.334 0.464 0 N-CA-C 109.961 -1.256 . . . . 0.0 109.961 -175.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 73.7 t -59.72 -47.63 90.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.852 0.358 . . . . 0.0 110.415 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -103.75 102.96 12.8 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.296 -1.002 . . . . 0.0 108.296 173.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.21 -40.03 11.77 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 106.937 -1.505 . . . . 0.0 106.937 -178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -153.49 139.86 18.62 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.224 1.41 . . . . 0.0 108.431 179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 65.3 t-80 -64.66 150.41 47.18 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -84.96 10.98 10.32 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 122.122 0.963 . . . . 0.0 110.017 -168.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -59.53 -24.01 63.32 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 124.486 1.115 . . . . 0.0 111.268 176.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 64.0 t-80 -72.82 116.0 12.79 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 121.819 0.818 . . . . 0.0 111.106 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -129.78 -36.73 1.58 Allowed 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 106.211 -1.774 . . . . 0.0 106.211 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 . . . . . 0 C--O 1.253 1.286 0 CA-C-N 113.944 -1.48 . . . . 0.0 107.474 179.762 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mtm . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.8 m -132.64 149.55 52.28 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 156.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 121.97 -166.6 14.65 Favored Glycine 0 CA--C 1.507 -0.447 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 168.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -100.26 147.04 26.2 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.902 -0.649 . . . . 0.0 110.755 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -90.15 132.47 35.43 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.4 p -137.0 144.47 32.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 168.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 50.8 mt-10 -107.72 135.76 48.61 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.6 t -123.03 123.51 68.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 C-N-CA 125.043 1.337 . . . . 0.0 108.672 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -107.91 124.76 50.61 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 87.6 t -115.19 121.86 68.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -120.08 120.99 37.86 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.3 tt -131.57 134.92 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 122.884 0.473 . . . . 0.0 110.487 177.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.0 m -103.56 124.99 49.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.271 0.629 . . . . 0.0 109.41 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.413 ' SG ' HG23 ' A' ' 48' ' ' ILE . 34.9 t -149.95 136.27 18.95 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.761 1.224 . . . . 0.0 109.91 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 57.77 34.18 24.12 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.213 1.005 . . . . 0.0 111.495 178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.68 -3.62 54.8 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.459 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -113.54 132.66 55.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.665 0.786 . . . . 0.0 110.757 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 77.2 m -93.12 124.53 37.17 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.733 -177.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -117.31 121.22 40.54 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -133.56 143.84 48.95 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -152.97 138.75 17.94 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.296 0.372 . . . . 0.0 110.175 178.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 78.8 m -93.19 128.57 39.21 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -115.15 141.7 47.66 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 27.0 mp0 -98.8 115.26 28.38 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 171.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.6 mt -108.25 124.24 50.0 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -130.18 106.06 8.34 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -174.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.7 147.68 39.59 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 123.324 0.65 . . . . 0.0 109.656 -164.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.1 t -82.68 -39.8 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 124.172 0.989 . . . . 0.0 109.885 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -123.78 155.24 38.3 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.497 0.719 . . . . 0.0 110.869 -174.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -60.74 -39.66 89.52 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.076 0.95 . . . . 0.0 111.324 178.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.1 -34.14 77.7 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.248 0.619 . . . . 0.0 110.724 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.95 -41.98 90.56 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.497 0.719 . . . . 0.0 111.361 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.2 -38.67 91.19 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 124.395 1.078 . . . . 0.0 110.252 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.2 mtpt -54.28 -53.13 57.92 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.985 0.914 . . . . 0.0 113.18 177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.9 pt-20 -66.66 -28.09 68.19 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.406 0.441 . . . . 0.0 111.764 179.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -67.12 -45.24 77.77 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 123.502 0.501 . . . . 0.0 110.357 173.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.3 mt -61.78 -39.63 92.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.732 0.813 . . . . 0.0 111.411 176.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -62.19 -42.31 99.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 123.757 0.66 . . . . 0.0 111.066 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -64.45 -46.44 83.12 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.603 0.564 . . . . 0.0 110.988 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.1 t -59.92 -45.06 95.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 124.899 1.28 . . . . 0.0 112.547 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.22 -47.15 80.79 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.258 0.623 . . . . 0.0 111.014 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -61.93 -43.99 97.7 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.403 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.73 -41.58 87.67 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.4 0.68 . . . . 0.0 110.857 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.3 tpm_? -64.19 -36.45 84.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.78 0.832 . . . . 0.0 110.298 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.7 mmm -86.86 -15.19 39.85 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.795 -175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -55.66 -55.42 40.82 Favored Pre-proline 0 CA--C 1.553 1.081 0 CA-C-O 118.621 -0.705 . . . . 0.0 111.415 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -66.14 -23.82 52.51 Favored 'Trans proline' 0 C--N 1.39 2.721 0 C-N-CA 121.371 1.38 . . . . 0.0 111.794 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.413 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -71.23 -30.48 40.47 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.021 0 C-N-CA 124.163 0.985 . . . . 0.0 110.768 -178.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' HA ' HD11 ' A' ' 108' ' ' LEU . 98.6 mttt -72.22 -40.23 67.95 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.315 0.646 . . . . 0.0 109.996 175.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -61.41 -30.62 70.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.654 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -83.18 -26.11 31.18 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.2 39.12 37.7 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.331 170.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.8 m -79.74 88.46 5.2 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -41.01 -45.04 2.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.77 1.628 . . . . 0.0 112.524 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -125.59 136.6 53.46 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.99 156.0 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 122.936 0.494 . . . . 0.0 110.705 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -116.17 121.85 43.3 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 173.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -119.99 124.65 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.2 m -112.93 128.24 56.42 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 88.5 mt -119.99 125.61 74.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 123.213 0.605 . . . . 0.0 109.855 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -116.72 127.69 54.62 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.756 -1.201 . . . . 0.0 107.756 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -108.23 144.98 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 -176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -84.05 127.2 33.73 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -100.07 143.7 29.97 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.631 0.772 . . . . 0.0 110.364 -172.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.2 m -55.96 -40.87 73.87 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.235 1.014 . . . . 0.0 111.482 -177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -163.24 168.57 20.45 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.186 0.594 . . . . 0.0 110.489 -176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.8 -59.45 4.48 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.562 1.145 . . . . 0.0 113.034 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.28 78.03 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.85 0.46 . . . . 0.0 110.902 177.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.07 -21.96 66.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 118.9 -0.571 . . . . 0.0 112.093 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -50.77 -42.9 58.28 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.083 0.553 . . . . 0.0 111.814 -176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -65.48 -43.82 89.04 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.99 0.807 . . . . 0.0 111.172 178.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.56 -43.69 93.12 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -73.22 -36.52 66.48 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.06 1.344 . . . . 0.0 112.855 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.06 -46.52 80.86 Favored 'General case' 0 C--O 1.213 -0.846 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -62.62 -45.56 92.32 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.21 1.404 . . . . 0.0 110.711 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -61.97 -52.59 63.41 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.359 1.464 . . . . 0.0 111.666 178.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -68.93 -30.8 69.34 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.578 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.56 -44.14 80.63 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.855 0.462 . . . . 0.0 110.882 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.26 -40.95 97.91 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.939 0.774 . . . . 0.0 110.455 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.42 ' O ' HG23 ' A' ' 84' ' ' VAL . 44.9 mm -61.03 -51.57 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.413 1.085 . . . . 0.0 111.599 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.08 -37.56 86.11 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.259 0.623 . . . . 0.0 110.35 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -57.26 -40.63 78.09 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.567 1.147 . . . . 0.0 110.842 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.71 -42.35 67.46 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.222 174.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 80' ' ' ILE . 49.8 t -63.13 -54.36 34.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.348 0.659 . . . . 0.0 109.886 -175.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -63.37 -35.98 82.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.152 0.981 . . . . 0.0 111.553 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.87 -33.81 76.9 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 111.421 177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -80.59 -17.23 52.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.203 1.001 . . . . 0.0 111.1 179.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.8 mt -97.73 -6.68 32.39 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.756 0.422 . . . . 0.0 110.117 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.91 18.6 39.69 Favored Glycine 0 C--N 1.351 1.396 0 O-C-N 123.462 0.477 . . . . 0.0 113.376 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -94.28 145.04 25.02 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -76.82 137.38 39.18 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.075 0.55 . . . . 0.0 110.154 178.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.49 -41.43 98.8 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.275 1.43 . . . . 0.0 111.47 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 92.8 p -62.91 -24.86 68.04 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.352 1.061 . . . . 0.0 113.541 178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -76.88 -0.41 24.0 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.045 0.538 . . . . 0.0 112.183 175.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 67.5 t -102.83 120.43 52.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.1 m -127.19 123.93 37.79 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 35.4 m95 -85.3 130.66 34.55 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -125.2 81.88 2.01 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.603 1.161 . . . . 0.0 108.344 172.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 66.03 -122.11 20.68 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.827 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -73.4 -17.84 61.22 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.428 1.091 . . . . 0.0 109.756 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.6 m -119.01 134.83 54.95 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.322 -170.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.1 p -111.17 134.43 53.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 123.055 0.542 . . . . 0.0 110.217 175.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -111.31 124.53 52.43 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.445 1.098 . . . . 0.0 108.782 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.1 t -121.98 132.69 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.301 1.04 . . . . 0.0 108.395 -174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -97.52 122.39 40.53 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 170.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -122.58 161.85 16.61 Favored Glycine 0 C--N 1.341 0.86 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.97 -176.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -116.72 145.58 43.37 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.473 ' C ' HD23 ' A' ' 108' ' ' LEU . 7.4 tt -139.28 135.09 33.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.847 1.259 . . . . 0.0 107.727 -173.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -101.9 111.54 23.83 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.993 0.425 . . . . 0.0 111.626 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -123.36 75.04 0.38 Allowed Glycine 0 C--N 1.342 0.867 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 72.5 t -74.9 -46.25 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 124.46 1.104 . . . . 0.0 111.592 -179.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -119.37 100.48 7.33 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.96 140.97 29.14 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.115 0.566 . . . . 0.0 109.916 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -91.54 150.83 21.02 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.796 175.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -133.74 71.28 1.46 Allowed 'General case' 0 N--CA 1.475 0.792 0 CA-C-O 121.76 0.791 . . . . 0.0 109.853 -175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -61.49 139.95 58.15 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -63.35 67.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 125.49 1.516 . . . . 0.0 114.803 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m170 -111.57 154.86 24.21 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.18 1.792 . . . . 0.0 107.904 178.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -135.06 65.37 1.56 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.8 0.81 . . . . 0.0 110.053 -178.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 . . . . . 0 N--CA 1.484 1.228 0 C-N-CA 123.854 0.862 . . . . 0.0 109.329 -178.221 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mmm . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -82.93 -137.3 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.821 0.819 . . . . 0.0 109.802 169.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.16 -120.29 10.33 Favored Glycine 0 C--N 1.341 0.843 0 CA-C-N 114.823 -1.08 . . . . 0.0 112.387 174.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -116.9 145.35 43.65 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.269 0.627 . . . . 0.0 110.647 -172.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -107.29 136.23 47.46 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -173.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.6 p -133.1 140.98 45.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 115.014 -0.994 . . . . 0.0 108.592 171.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -111.03 129.93 55.75 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -123.49 120.05 58.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 114.808 -1.087 . . . . 0.0 108.302 -173.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -105.03 123.15 47.3 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 107.254 -1.387 . . . . 0.0 107.254 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.9 t -110.48 119.58 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -122.05 119.28 30.96 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.5 tt -130.45 135.8 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.356 0.662 . . . . 0.0 110.358 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -108.5 125.35 51.7 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-O 120.9 0.381 . . . . 0.0 109.994 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.5 t -150.32 144.39 25.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.481 1.512 . . . . 0.0 108.703 -177.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.9 t30 60.03 30.58 20.05 Favored 'General case' 0 N--CA 1.5 2.031 0 CA-C-O 121.791 0.805 . . . . 0.0 110.63 175.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.26 -0.39 59.62 Favored Glycine 0 C--N 1.358 1.769 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.553 178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -116.9 138.97 51.17 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.065 0.946 . . . . 0.0 110.352 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.3 m -94.69 124.7 38.88 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -113.24 118.18 33.94 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.777 1.231 . . . . 0.0 109.001 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -127.09 143.78 51.19 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.828 0.451 . . . . 0.0 111.258 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 64.8 ttt180 -154.27 133.52 12.58 Favored 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.897 0.748 . . . . 0.0 109.781 178.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 68.6 m -99.08 128.27 45.19 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.954 0.902 . . . . 0.0 109.646 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -115.37 141.72 47.66 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.577 0.751 . . . . 0.0 110.341 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -101.98 118.25 36.52 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 67.8 mt -110.67 114.14 27.28 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.244 1.018 . . . . 0.0 108.495 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -110.82 114.02 27.04 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -177.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.47 151.78 38.74 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.094 0.557 . . . . 0.0 110.2 -166.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 69.4 t -101.86 -51.12 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 124.587 1.155 . . . . 0.0 110.407 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -103.16 151.21 22.87 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.097 0.959 . . . . 0.0 109.95 -177.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.2 -37.71 75.34 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.285 0.634 . . . . 0.0 111.725 176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.75 -34.26 77.9 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.601 0.36 . . . . 0.0 110.934 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -65.17 -39.43 92.93 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.179 0.592 . . . . 0.0 110.511 -176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.82 -39.88 83.89 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 124.155 0.982 . . . . 0.0 110.104 -178.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -54.84 -49.82 70.14 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.301 1.04 . . . . 0.0 112.562 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.1 pt-20 -65.65 -28.3 69.0 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.166 0.586 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.63 -44.56 77.68 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.345 0.658 . . . . 0.0 110.628 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.85 -38.82 92.32 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.734 0.814 . . . . 0.0 111.037 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -59.86 -46.28 89.8 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.404 0.682 . . . . 0.0 111.039 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -62.99 -48.33 79.3 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.0 t -61.0 -47.0 95.59 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 124.756 1.223 . . . . 0.0 111.887 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 45' ' ' MET . 34.0 mt -64.49 -45.21 88.28 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.22 0.608 . . . . 0.0 111.524 178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -60.05 -45.76 91.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.055 0.542 . . . . 0.0 112.327 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.77 -39.37 93.51 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.958 0.503 . . . . 0.0 110.735 179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -66.16 -41.05 90.88 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.58 0.352 . . . . 0.0 111.716 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 95.9 mmm -87.59 -14.72 39.37 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -172.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -54.78 -55.46 38.14 Favored Pre-proline 0 CA--C 1.567 1.629 0 CA-C-O 118.927 -0.559 . . . . 0.0 111.656 175.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -66.8 -24.91 46.3 Favored 'Trans proline' 0 C--N 1.396 3.03 0 C-N-CA 121.986 1.791 . . . . 0.0 112.632 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.3 mm -67.77 -33.81 63.93 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 C-N-CA 124.227 1.011 . . . . 0.0 110.911 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -70.27 -38.54 75.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.811 0.844 . . . . 0.0 110.031 175.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.86 -31.82 72.98 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.669 174.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.1 mt -76.31 -26.44 55.83 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.18 37.52 9.03 Favored Glycine 0 C--N 1.345 1.041 0 CA-C-N 115.451 -0.795 . . . . 0.0 113.82 171.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 87.3 m -87.33 103.9 15.91 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.771 0.285 . . . . 0.0 111.077 177.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -52.18 -55.98 17.56 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.869 1.268 . . . . 0.0 110.006 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -119.79 144.91 47.04 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.302 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.5 m -134.74 152.11 32.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 123.996 0.918 . . . . 0.0 109.233 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -116.96 123.7 47.57 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 170.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 79.3 mt -121.58 129.94 75.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.5 m -116.14 125.73 52.72 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 171.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 89.8 mt -120.44 125.04 73.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 C-N-CA 123.435 0.694 . . . . 0.0 109.144 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.8 ttt180 -109.74 128.55 55.36 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 178.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -107.85 139.6 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 107.67 -1.233 . . . . 0.0 107.67 -176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.44 129.77 36.58 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -175.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -102.79 143.35 32.53 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.978 -178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.9 m -59.18 -39.83 83.77 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 123.947 0.779 . . . . 0.0 110.924 -177.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -155.79 169.47 24.3 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.516 0.726 . . . . 0.0 110.663 -177.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.08 83.02 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.393 1.477 . . . . 0.0 112.865 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.23 -35.47 81.15 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 120.927 0.394 . . . . 0.0 111.075 177.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -65.38 -25.88 67.76 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.728 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -53.31 -41.8 66.03 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.93 0.492 . . . . 0.0 112.203 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -67.38 -50.76 58.32 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.448 0.699 . . . . 0.0 111.177 -174.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -69.38 -46.59 66.54 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.533 -176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -70.08 -32.02 69.9 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.46 88.86 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 119.335 0.97 . . . . 0.0 109.574 177.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -62.48 -40.94 98.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.151 0.98 . . . . 0.0 111.678 175.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -63.93 -48.86 74.87 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.134 0.574 . . . . 0.0 110.647 177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -69.73 -31.97 70.26 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.266 0.626 . . . . 0.0 109.746 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.9 -43.73 91.06 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.313 0.645 . . . . 0.0 109.909 175.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.06 -40.56 94.9 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.059 0.849 . . . . 0.0 111.461 174.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.6 mm -58.34 -51.85 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.058 0.543 . . . . 0.0 109.857 175.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.5 mt -66.45 -35.73 81.03 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.758 0.823 . . . . 0.0 110.402 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -55.09 -43.15 73.71 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.623 0.769 . . . . 0.0 110.741 177.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -72.85 -41.48 64.75 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 118.936 -0.554 . . . . 0.0 111.47 175.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 51.2 t -65.95 -48.8 80.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 CA-C-O 121.327 0.584 . . . . 0.0 110.598 -173.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -65.43 -35.48 81.05 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.603 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.91 -29.4 69.27 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 122.889 0.476 . . . . 0.0 111.461 172.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -76.89 -22.97 52.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.069 0.947 . . . . 0.0 110.815 178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.9 mt -106.07 -9.4 17.01 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 122.958 0.503 . . . . 0.0 112.193 -171.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.3 29.66 10.99 Favored Glycine 0 N--CA 1.472 1.092 0 CA-C-O 121.336 0.409 . . . . 0.0 113.249 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -100.22 142.06 32.21 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 174.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -75.99 140.05 41.81 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.973 0.509 . . . . 0.0 110.268 178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -64.05 -41.67 97.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.319 0.647 . . . . 0.0 110.367 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 90.9 p -61.35 -25.88 67.45 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.922 1.289 . . . . 0.0 112.962 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -79.64 -1.24 37.27 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.996 0.918 . . . . 0.0 110.932 179.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 63.5 t -100.45 119.39 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.183 0.993 . . . . 0.0 109.52 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 90.5 m -128.72 122.05 29.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.878 0.471 . . . . 0.0 109.953 -179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -90.41 132.22 35.75 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.218 0.607 . . . . 0.0 110.597 177.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -127.79 94.54 3.97 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 170.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.2 -122.39 23.46 Favored Glycine 0 CA--C 1.529 0.943 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.163 -179.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.2 p30 -88.44 3.64 49.34 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.446 0.699 . . . . 0.0 111.581 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 85.9 m -125.75 132.57 52.3 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -172.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -115.42 135.06 56.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.2 m -111.79 123.15 49.64 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -122.28 132.04 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -109.54 134.8 51.48 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 172.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.35 169.65 24.45 Favored Glycine 0 C--N 1.342 0.888 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.631 -175.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -136.08 129.83 32.49 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.484 0.714 . . . . 0.0 109.186 -178.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.5 mt -130.13 156.39 44.63 Favored 'General case' 0 C--O 1.245 0.817 0 C-N-CA 124.009 0.924 . . . . 0.0 109.345 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -78.75 67.78 4.57 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -67.42 141.61 39.28 Favored Glycine 0 C--N 1.337 0.638 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.92 -177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 93.4 t -127.28 118.72 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 176.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -73.1 103.77 3.96 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 123.806 0.691 . . . . 0.0 109.796 -176.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.9 mt -94.83 -0.94 53.68 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.358 0.663 . . . . 0.0 110.544 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -85.4 105.1 15.79 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.238 0.542 . . . . 0.0 109.961 -175.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -85.48 143.8 28.33 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 114.87 -1.059 . . . . 0.0 110.114 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 57.58 41.0 26.39 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.218 1.007 . . . . 0.0 108.468 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -72.02 -9.08 57.88 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.473 -1.239 . . . . 0.0 113.003 179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -91.52 -9.35 44.71 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.579 0.352 . . . . 0.0 111.324 172.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -102.78 145.96 28.96 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 0.0 109.734 -176.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 . . . . . 0 CA--C 1.556 1.196 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 -177.82 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HB2' ' CE2' ' A' ' 26' ' ' TYR . 94.4 mmm . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.7 m -149.48 4.8 0.6 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.989 0.916 . . . . 0.0 112.101 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.66 -139.71 10.61 Favored Glycine 0 C--N 1.348 1.21 0 O-C-N 123.308 0.38 . . . . 0.0 113.423 -161.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.28 158.61 36.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.903 0.881 . . . . 0.0 108.72 -173.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -103.8 130.85 51.39 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 178.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -123.27 142.26 40.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 165.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 95.9 mt-10 -105.72 128.69 53.84 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 176.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.8 t -117.1 121.14 67.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.707 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -104.09 120.29 40.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 176.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 96.7 t -111.99 119.88 61.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 179.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -120.62 114.31 21.52 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.274 -0.875 . . . . 0.0 108.985 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.7 tt -125.11 131.72 72.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.102 0.561 . . . . 0.0 110.138 -175.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.9 m -109.59 126.61 53.79 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.1 t -143.78 144.38 31.78 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.611 1.164 . . . . 0.0 109.102 176.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.2 t30 68.42 -80.12 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.885 1.274 . . . . 0.0 109.891 176.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.06 4.84 0.06 OUTLIER Glycine 0 N--CA 1.462 0.42 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -121.48 132.85 54.96 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.263 1.025 . . . . 0.0 110.469 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 87.2 m -96.85 127.95 43.33 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.301 1.041 . . . . 0.0 109.066 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -115.3 120.91 41.22 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -177.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -135.8 142.98 44.96 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.319 0.647 . . . . 0.0 110.735 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -154.91 140.76 18.19 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.405 -0.816 . . . . 0.0 108.89 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 99.6 m -100.18 133.27 44.82 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 175.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -119.75 146.67 45.43 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.864 0.866 . . . . 0.0 108.865 -176.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 83.7 mt-30 -102.71 120.34 40.4 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.7 mt -114.72 116.18 28.25 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.741 0.816 . . . . 0.0 109.176 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 1' ' ' MET . 44.2 t80 -112.62 113.29 25.36 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.234 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -143.1 152.59 42.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.484 0.714 . . . . 0.0 109.738 -170.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 87.2 t -93.44 -53.46 8.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -99.52 154.21 18.43 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.913 0.885 . . . . 0.0 109.471 -177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -60.14 -39.18 85.43 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.797 0.839 . . . . 0.0 111.019 178.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -65.01 -33.75 76.8 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.564 1.146 . . . . 0.0 111.848 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -66.68 -36.29 82.16 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.388 0.675 . . . . 0.0 111.031 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.29 -39.66 78.2 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.837 0.855 . . . . 0.0 110.523 174.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . 43.0 mtpt -54.25 -51.82 63.32 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.323 0.649 . . . . 0.0 111.723 -177.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -62.66 -33.82 75.83 Favored 'General case' 0 C--N 1.354 0.785 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.073 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -65.32 -43.13 92.0 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.828 0.851 . . . . 0.0 110.401 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.21 -43.22 96.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.9 0.88 . . . . 0.0 110.705 176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -62.58 -44.87 95.25 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 123.517 0.727 . . . . 0.0 111.057 178.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -61.74 -46.84 87.89 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 48.2 t -63.45 -45.68 97.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.836 1.254 . . . . 0.0 112.024 -178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.19 -44.4 92.12 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.217 0.607 . . . . 0.0 111.178 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -65.54 -37.34 86.45 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.897 0.479 . . . . 0.0 111.122 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -58.46 -42.01 86.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.649 0.779 . . . . 0.0 110.95 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -71.61 -18.82 62.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.909 178.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -91.93 -10.88 37.87 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.36 -51.95 74.11 Favored Pre-proline 0 CA--C 1.569 1.698 0 CA-C-O 118.741 -0.647 . . . . 0.0 111.819 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -75.89 -14.94 19.11 Favored 'Trans proline' 0 C--N 1.391 2.801 0 C-N-CA 121.811 1.674 . . . . 0.0 112.7 179.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 47.2 mm -63.51 -29.88 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.584 0.754 . . . . 0.0 109.874 -176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -71.5 -43.63 66.16 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.357 -178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.76 -34.92 75.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.45 0.7 . . . . 0.0 109.74 172.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.1 mt -74.94 -24.25 58.45 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.03 37.93 41.98 Favored Glycine 0 C--N 1.345 1.062 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.216 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 33.7 m -82.96 128.92 34.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -80.9 -22.77 39.47 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.433 1.093 . . . . 0.0 112.08 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -152.23 136.17 16.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.772 0.829 . . . . 0.0 109.201 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.0 m -134.38 155.65 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.297 1.039 . . . . 0.0 109.898 -176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -113.56 125.15 53.87 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 174.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.4 mt -123.65 123.99 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -174.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.0 m -113.95 131.01 56.47 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 176.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.99 127.69 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.196 0.998 . . . . 0.0 109.558 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -120.57 130.29 54.14 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.1 p -111.04 137.75 42.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -174.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 39.9 ttmt -102.28 127.94 49.03 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 175.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -95.87 134.26 39.05 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.326 -177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.1 m -52.57 -52.28 55.8 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.927 0.891 . . . . 0.0 111.377 -173.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 68.3 t0 -104.11 115.18 29.97 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.569 0.748 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.19 -27.19 68.24 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.776 0.831 . . . . 0.0 111.532 -178.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.49 -48.35 49.58 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.021 0.529 . . . . 0.0 111.965 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -74.39 -20.79 59.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -42.85 -31.77 0.54 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 -171.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -66.69 -46.6 75.1 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.94 -39.91 75.81 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -67.98 -32.54 73.01 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.017 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.11 -43.83 94.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.531 0.732 . . . . 0.0 112.256 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.07 -41.43 92.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.931 -1.032 . . . . 0.0 111.635 173.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -64.06 -48.84 74.66 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.4 0.68 . . . . 0.0 111.272 173.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -71.4 -30.59 66.27 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.871 0.868 . . . . 0.0 109.242 -171.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.21 74.9 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.052 0.541 . . . . 0.0 110.055 176.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.38 94.84 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 123.961 0.904 . . . . 0.0 111.345 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.6 mm -60.93 -47.22 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.861 0.864 . . . . 0.0 110.478 179.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.2 mt -67.16 -40.06 86.61 Favored 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 124.239 1.015 . . . . 0.0 110.254 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.68 -38.99 89.83 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.775 0.83 . . . . 0.0 111.026 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -67.21 -39.52 86.33 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.272 176.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 44.6 t -64.0 -49.57 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 124.232 1.013 . . . . 0.0 110.747 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -64.15 -38.41 90.96 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 124.145 0.903 . . . . 0.0 110.525 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.13 -31.99 73.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.996 0.518 . . . . 0.0 111.389 175.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.88 -10.32 58.88 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.023 0.529 . . . . 0.0 110.254 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.7 mt -99.91 -5.67 27.94 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.728 0.811 . . . . 0.0 110.724 179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 92.74 15.41 52.72 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.1 -0.833 . . . . 0.0 115.168 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -92.26 143.57 26.28 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.627 0.771 . . . . 0.0 111.442 -178.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -95.61 166.66 11.73 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.93 0.892 . . . . 0.0 111.821 -179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -65.01 -27.31 68.74 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 125.088 1.355 . . . . 0.0 112.5 176.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.2 p -79.69 -5.99 56.3 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.367 1.067 . . . . 0.0 111.863 178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -109.87 -10.02 14.77 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.724 0.81 . . . . 0.0 111.756 -177.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 72.9 t -111.27 117.79 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -125.63 131.48 52.65 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.467 0.707 . . . . 0.0 110.242 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -99.98 134.85 42.28 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.221 0.608 . . . . 0.0 110.54 175.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.4 t0 -154.99 103.86 2.43 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.83 1.252 . . . . 0.0 109.335 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.84 50.0 9.53 Favored Glycine 0 C--N 1.35 1.319 0 CA-C-O 119.741 -0.477 . . . . 0.0 113.95 176.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 54.64 23.61 4.85 Favored 'General case' 0 N--CA 1.503 2.196 0 C-N-CA 124.737 1.215 . . . . 0.0 111.801 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 29.9 m -131.36 137.13 48.6 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.037 1.335 . . . . 0.0 107.656 -175.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -111.91 126.2 69.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 -174.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.8 m -112.13 123.64 50.69 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.747 0.819 . . . . 0.0 109.115 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.1 t -123.7 131.43 73.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.732 0 C-N-CA 124.856 1.263 . . . . 0.0 109.596 -172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -94.31 130.1 40.73 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 174.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.91 168.11 25.15 Favored Glycine 0 N--CA 1.466 0.651 0 CA-C-N 117.81 0.277 . . . . 0.0 112.896 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -147.46 120.2 8.64 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.509 HD22 ' O ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -90.11 158.74 17.14 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 123.651 0.78 . . . . 0.0 111.283 -174.487 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -89.75 145.93 24.85 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.276 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 110.61 -36.37 4.29 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -173.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.6 t -101.5 -52.91 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.663 0.785 . . . . 0.0 110.611 170.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -109.84 76.18 0.98 Allowed 'General case' 0 C--O 1.24 0.571 0 C-N-CA 123.795 0.838 . . . . 0.0 109.069 168.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 tp -65.0 128.06 34.19 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.719 -167.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 53.73 45.22 28.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.824 1.25 . . . . 0.0 112.801 175.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -73.17 -54.78 7.6 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 105.928 -1.879 . . . . 0.0 105.928 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -91.04 70.05 6.29 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -79.47 5.76 12.02 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.565 1.146 . . . . 0.0 113.292 -178.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -153.38 165.18 36.58 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.047 0.939 . . . . 0.0 109.469 -178.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -70.76 134.03 47.07 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.529 0.732 . . . . 0.0 110.062 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.8 m80 . . . . . 0 CA--C 1.554 1.114 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.631 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 121.233 0.54 . . . . 0.0 111.077 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 4' ' ' LYS . 30.6 t -79.22 -149.61 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 176.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.09 65.23 1.25 Allowed Glycine 0 C--N 1.337 0.6 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -165.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' N ' ' O ' ' A' ' 2' ' ' SER . 99.2 mttt -139.71 147.55 41.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.329 0.652 . . . . 0.0 110.753 167.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -74.3 121.89 22.03 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.169 -175.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.7 p -130.69 140.71 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 56.4 mt-10 -106.77 136.2 47.0 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 172.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 97.8 t -120.07 124.02 71.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 124.236 1.014 . . . . 0.0 109.616 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -101.75 117.05 34.07 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 176.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.3 t -112.65 119.47 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -119.29 124.33 46.4 Favored 'General case' 0 C--O 1.216 -0.685 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -178.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -123.87 133.87 68.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-O 121.084 0.468 . . . . 0.0 111.021 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -103.76 128.1 51.19 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 123.891 0.877 . . . . 0.0 108.655 177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 48' ' ' ILE . 40.9 t -144.98 119.04 9.39 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.887 0.875 . . . . 0.0 109.976 -172.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.1 t30 55.23 34.72 23.34 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.55 1.14 . . . . 0.0 111.01 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.7 2.93 88.54 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.831 -1.077 . . . . 0.0 115.004 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -110.14 129.21 55.74 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.634 0.774 . . . . 0.0 110.363 -179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 m -99.8 122.82 43.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.019 0.928 . . . . 0.0 110.113 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -122.21 126.26 47.84 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.086 0.954 . . . . 0.0 108.963 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -134.94 147.06 49.68 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.833 0.349 . . . . 0.0 110.715 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -149.66 138.88 21.31 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.506 0.722 . . . . 0.0 109.492 177.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.6 m -99.4 131.58 45.31 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.974 0.91 . . . . 0.0 109.689 177.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -118.91 144.58 46.34 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 124.09 0.956 . . . . 0.0 109.413 -176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.455 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.8 mp0 -100.26 116.45 32.29 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 172.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 87.9 mt -110.83 137.11 48.88 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.841 0.856 . . . . 0.0 109.185 -178.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -142.62 125.82 16.46 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 170.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.7 144.21 28.15 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.719 -174.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -77.99 -51.68 17.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.851 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -101.68 150.47 23.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.823 1.249 . . . . 0.0 110.017 -177.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -61.37 -38.98 88.94 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 124.431 1.092 . . . . 0.0 110.614 175.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -63.28 -36.18 82.82 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 114.964 -1.017 . . . . 0.0 111.218 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -65.47 -41.93 92.82 Favored 'General case' 0 C--N 1.358 0.94 0 C-N-CA 122.172 0.189 . . . . 0.0 110.684 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -39.53 93.62 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 119.145 -0.455 . . . . 0.0 110.103 178.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.11 -52.43 65.32 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 123.826 0.704 . . . . 0.0 112.028 -177.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -66.55 -27.68 67.94 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 124.521 1.138 . . . . 0.0 111.596 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.28 -42.88 83.07 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.433 0.693 . . . . 0.0 111.428 174.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 80.0 mt -63.45 -38.58 91.68 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.144 0.903 . . . . 0.0 110.466 176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -60.07 -46.53 89.25 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.785 0.834 . . . . 0.0 111.581 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.33 -46.12 90.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.024 0.53 . . . . 0.0 110.713 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 50.6 t -59.56 -47.09 92.19 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.634 1.174 . . . . 0.0 111.528 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.413 ' O ' ' HG2' ' A' ' 45' ' ' MET . 32.2 mt -63.8 -47.2 81.84 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.738 0.649 . . . . 0.0 110.289 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -65.25 -33.39 75.88 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -61.87 -42.87 99.57 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.321 0.388 . . . . 0.0 110.717 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 48' ' ' ILE . 6.3 mmp_? -73.84 -25.44 60.07 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.144 178.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 96.1 mmm -86.8 -15.51 39.04 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.172 0.589 . . . . 0.0 111.939 -174.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 118' ' ' HIS . 91.4 m-20 -60.16 -59.41 13.92 Favored Pre-proline 0 CA--C 1.569 1.708 0 CA-C-O 118.537 -0.744 . . . . 0.0 111.727 -178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -66.76 -16.48 50.36 Favored 'Trans proline' 0 C--N 1.386 2.531 0 C-N-CA 122.093 1.862 . . . . 0.0 113.958 176.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.486 HG23 ' SG ' ' A' ' 14' ' ' CYS . 42.9 mm -71.49 -35.43 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.92 0.888 . . . . 0.0 111.896 -177.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.557 ' HA ' HD21 ' A' ' 108' ' ' LEU . 57.4 mtmt -63.74 -34.77 78.64 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.745 0.418 . . . . 0.0 110.365 178.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -65.03 -29.64 70.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.697 0.799 . . . . 0.0 111.318 174.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 96.7 mt -81.74 -26.45 34.54 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.04 22.86 70.36 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.423 167.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.1 p -73.22 82.53 1.34 Allowed 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.842 0.857 . . . . 0.0 108.742 173.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -46.27 -35.44 5.27 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -107.66 131.76 54.05 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.0 m -131.01 149.39 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.845 0.858 . . . . 0.0 109.576 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -129.66 127.1 39.87 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.453 0.701 . . . . 0.0 109.803 176.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 87.5 mt -120.96 125.11 73.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.573 1.149 . . . . 0.0 109.924 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.1 m -112.12 130.31 55.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 175.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -118.46 129.95 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 122.976 0.51 . . . . 0.0 110.368 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 68.6 ttp85 -116.88 129.44 56.07 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.8 p -111.26 140.1 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -85.23 128.9 34.86 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -176.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -103.67 144.73 31.06 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.3 m -62.77 -41.3 99.18 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.239 -1.801 . . . . 0.0 110.854 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -160.95 170.11 21.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.659 0.384 . . . . 0.0 110.654 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -38.17 89.99 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.176 0.99 . . . . 0.0 111.857 177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.59 -43.75 62.93 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.425 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -68.73 -37.28 79.32 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.409 -175.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -55.88 -26.51 47.54 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -64.39 -48.41 75.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.974 0.91 . . . . 0.0 112.121 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -74.18 -42.05 60.48 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.048 0.539 . . . . 0.0 110.697 177.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -66.16 -35.81 81.45 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.489 1.116 . . . . 0.0 112.143 -172.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.65 -47.37 81.59 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.879 0.872 . . . . 0.0 112.508 174.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.6 -43.95 93.54 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.031 176.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.04 -50.06 72.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.169 0.587 . . . . 0.0 110.158 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -70.59 -35.73 73.16 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.417 1.087 . . . . 0.0 110.113 -174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.02 88.84 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.992 0.917 . . . . 0.0 110.714 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.67 -40.43 96.81 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.537 0.735 . . . . 0.0 111.054 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.408 ' O ' HG23 ' A' ' 84' ' ' VAL . 36.3 mm -60.54 -52.03 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.976 0.91 . . . . 0.0 110.814 178.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 45.4 mt -65.43 -37.33 86.59 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.962 0.505 . . . . 0.0 111.861 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -58.67 -41.93 87.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.25 0.62 . . . . 0.0 110.22 177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.95 -42.77 72.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.382 -0.826 . . . . 0.0 111.12 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 80' ' ' ILE . 42.4 t -64.46 -50.52 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 123.955 0.902 . . . . 0.0 111.329 -177.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 26.4 m-85 -64.8 -37.19 86.77 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.63 0.772 . . . . 0.0 112.229 -176.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -27.73 68.47 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 122.973 0.509 . . . . 0.0 111.839 174.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -82.1 -17.03 47.97 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.834 0.854 . . . . 0.0 110.957 176.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.1 mt -94.62 -20.6 19.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.761 0.424 . . . . 0.0 110.864 -174.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 121.32 6.35 8.95 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-O 119.372 -0.682 . . . . 0.0 114.274 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -86.23 131.46 34.23 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 118.291 1.045 . . . . 0.0 110.663 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t-20 -87.43 100.29 12.63 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.465 0.706 . . . . 0.0 111.358 -178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 66.8 t0 26.51 -81.55 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 124.863 1.265 . . . . 0.0 113.986 173.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.4 p -63.29 -14.64 51.91 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.115 0.966 . . . . 0.0 113.144 -170.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -64.3 -13.77 51.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.182 0.593 . . . . 0.0 110.647 177.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.6 t -104.35 119.99 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 125.113 1.365 . . . . 0.0 110.091 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -128.9 129.9 46.11 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 118.453 0.57 . . . . 0.0 110.591 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -102.73 129.45 49.37 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.144 0.977 . . . . 0.0 111.472 177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -143.93 105.29 4.26 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.111 0.965 . . . . 0.0 108.981 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.88 42.44 38.05 Favored Glycine 0 C--N 1.346 1.111 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.522 173.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 65.85 10.58 6.99 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.896 1.278 . . . . 0.0 113.025 -177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.4 m -122.59 132.96 54.54 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.4 p -110.5 134.67 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -169.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 76.1 m -113.62 124.42 52.29 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 172.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.431 HG21 ' CE2' ' A' ' 85' ' ' PHE . 57.2 t -128.48 123.78 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.203 1.001 . . . . 0.0 108.346 -173.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -125.59 139.34 53.67 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 122.479 0.312 . . . . 0.0 110.29 -176.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.49 -174.58 37.34 Favored Glycine 0 C--O 1.244 0.746 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.342 -174.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -89.36 140.3 29.64 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.761 0.791 . . . . 0.0 111.576 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.557 HD21 ' HA ' ' A' ' 49' ' ' LYS . 63.8 tp -75.54 139.48 42.17 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.542 1.137 . . . . 0.0 109.961 175.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 78.06 -37.36 0.23 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.423 1.889 . . . . 0.0 109.649 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -60.02 -40.59 97.22 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 171.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -96.05 94.96 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.887 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 173.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -160.3 122.41 3.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.013 0.925 . . . . 0.0 108.933 -178.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.8 mt -115.72 172.05 7.37 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 168.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -75.64 64.61 1.71 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.468 1.107 . . . . 0.0 111.969 -176.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.17 65.7 1.55 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.151 1.381 . . . . 0.0 108.159 176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -81.65 103.45 11.36 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 122.34 1.067 . . . . 0.0 108.709 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -100.48 -36.25 9.26 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.908 -174.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 46' ' ' ASP . 21.9 t-160 -72.34 106.56 4.53 Favored 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 124.409 1.084 . . . . 0.0 110.002 -178.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -136.05 44.36 2.46 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.25 1.02 . . . . 0.0 109.322 179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.25 1.079 0 C-N-CA 123.727 0.811 . . . . 0.0 109.558 -177.38 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.7 mmm . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.8 t -167.23 31.03 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.582 0.753 . . . . 0.0 111.055 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.78 -111.92 3.46 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-N 116.085 -0.507 . . . . 0.0 113.556 174.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -109.76 149.72 29.38 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.982 0.913 . . . . 0.0 110.366 179.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.04 140.04 50.33 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -174.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -125.06 142.33 42.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.567 0.747 . . . . 0.0 109.899 175.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.424 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 96.0 mt-10 -101.56 136.85 40.71 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -121.26 121.37 64.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 124.381 1.072 . . . . 0.0 108.825 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.9 tt0 -108.14 118.81 37.73 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 72.5 t -110.82 121.64 63.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -174.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -120.02 118.13 29.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.1 tt -126.7 129.74 71.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 CA-C-O 121.364 0.602 . . . . 0.0 109.836 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.6 m -115.8 130.11 56.71 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.33 0.652 . . . . 0.0 111.09 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t -152.07 151.23 30.84 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.164 0.985 . . . . 0.0 111.335 168.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.5 t30 52.92 34.18 16.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.268 1.427 . . . . 0.0 112.817 174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 1.52 86.6 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 115.93 -0.577 . . . . 0.0 113.879 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -115.61 143.95 44.6 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.21 0.604 . . . . 0.0 110.428 -179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.7 m -115.07 130.57 56.96 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.144 0.978 . . . . 0.0 108.661 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -114.77 118.22 32.98 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -136.13 142.58 44.25 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.082 0.553 . . . . 0.0 110.21 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -158.16 140.37 14.22 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.909 177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -94.87 130.07 41.62 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.288 1.035 . . . . 0.0 109.693 173.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -116.8 145.15 43.72 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.588 1.155 . . . . 0.0 108.594 -175.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.424 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 84.5 mt-30 -103.07 116.1 31.87 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 171.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' A' ' 36' ' ' LYS . 29.4 mt -110.47 106.72 16.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.404 1.082 . . . . 0.0 109.602 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -111.61 108.13 17.51 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -172.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.436 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -147.48 141.99 26.49 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.99 0.916 . . . . 0.0 109.489 -169.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 55.5 t -78.65 -53.69 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 CA-C-O 121.249 0.547 . . . . 0.0 110.304 176.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -98.16 155.99 16.89 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.342 0.657 . . . . 0.0 110.198 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -59.3 -39.6 83.51 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.956 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -64.36 -35.81 82.11 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.334 1.054 . . . . 0.0 111.527 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 62.9 mt-10 -64.93 -37.26 87.04 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.291 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -40.18 74.46 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.654 0.781 . . . . 0.0 110.262 -177.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -56.77 -47.88 79.13 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.603 0.761 . . . . 0.0 112.238 -171.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 -63.68 -32.26 73.68 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.293 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HB3' HD22 ' A' ' 25' ' ' LEU . 68.7 mttm -64.64 -43.07 94.83 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.172 0.589 . . . . 0.0 111.079 176.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.6 mt -63.1 -39.39 94.57 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 123.737 0.648 . . . . 0.0 110.804 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -59.68 -43.73 93.91 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.788 0.435 . . . . 0.0 111.556 175.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -61.81 -47.09 86.69 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.452 0.701 . . . . 0.0 110.719 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -61.88 -46.63 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.56 1.144 . . . . 0.0 112.172 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.2 -44.73 94.51 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 124.064 0.852 . . . . 0.0 111.418 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -64.15 -37.47 87.56 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.219 0.608 . . . . 0.0 110.432 179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -62.71 -44.77 95.36 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.585 0.754 . . . . 0.0 112.173 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -71.88 -21.53 61.64 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.504 0.721 . . . . 0.0 111.283 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.2 mmm -89.24 -7.88 54.6 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.88 175.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -64.73 -53.07 46.58 Favored Pre-proline 0 N--CA 1.503 2.204 0 CA-C-N 119.837 1.199 . . . . 0.0 113.426 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.17 -21.4 55.47 Favored 'Trans proline' 0 C--N 1.394 2.948 0 C-N-CA 121.709 1.606 . . . . 0.0 111.811 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.7 mm -67.72 -30.39 48.38 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.227 0 C-N-CA 124.766 1.226 . . . . 0.0 110.916 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.0 -41.85 61.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.277 0.631 . . . . 0.0 109.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.0 ttpt -59.76 -30.73 69.06 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.277 172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.447 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 97.3 mt -80.32 -27.22 38.46 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 174.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.27 27.09 64.55 Favored Glycine 0 C--N 1.347 1.141 0 CA-C-N 115.91 -0.587 . . . . 0.0 112.265 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 51' ' ' LEU . 36.8 m -60.91 120.85 10.99 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.54 -173.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.73 -62.31 1.74 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 122.987 0.515 . . . . 0.0 110.317 176.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -121.23 141.77 50.55 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.029 0.931 . . . . 0.0 109.104 178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.3 m -131.94 156.71 42.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.226 1.01 . . . . 0.0 109.297 -177.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttm180 -119.55 126.4 51.14 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.2 mt -119.4 133.18 67.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 C-N-CA 123.855 0.862 . . . . 0.0 108.944 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 45.3 m -120.19 127.22 52.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 172.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 90.6 mt -122.03 124.39 71.14 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 C-N-CA 123.536 0.734 . . . . 0.0 110.105 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -109.98 127.94 55.09 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.76 140.42 29.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -86.77 127.83 35.01 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.115 0.483 . . . . 0.0 110.237 -175.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -103.0 141.09 36.4 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 73.7 m -55.1 -39.41 69.29 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 127.276 2.231 . . . . 0.0 115.267 -179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -157.52 169.15 25.34 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.09 -46.41 87.51 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.426 0.69 . . . . 0.0 111.421 -178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.4 -34.36 78.12 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.083 0.553 . . . . 0.0 111.378 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -66.87 -26.54 66.94 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.682 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -48.13 -44.49 32.17 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.431 1.271 . . . . 0.0 114.431 -170.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.12 -47.15 78.14 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.3 0.64 . . . . 0.0 111.061 -177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -67.5 -44.66 77.94 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.149 0.98 . . . . 0.0 111.044 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -66.05 -43.64 86.88 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.435 1.094 . . . . 0.0 109.454 -177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -42.67 91.33 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.087 0.867 . . . . 0.0 111.613 177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -57.12 -46.73 82.39 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.451 0.701 . . . . 0.0 111.005 176.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.84 -47.23 78.7 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.13 0.972 . . . . 0.0 110.369 178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -68.59 -30.47 69.23 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.54 -173.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.09 -43.26 86.99 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.329 0.652 . . . . 0.0 109.943 174.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.43 -41.23 93.76 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.496 0.719 . . . . 0.0 111.117 176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.7 mm -58.69 -55.79 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.558 1.143 . . . . 0.0 110.915 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 64.9 mt -67.52 -35.2 78.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.761 0.824 . . . . 0.0 112.324 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.7 t30 -55.08 -43.84 74.28 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.319 0.648 . . . . 0.0 110.448 178.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -71.7 -44.81 63.54 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.722 177.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 42.6 t -61.54 -50.85 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 123.948 0.899 . . . . 0.0 110.852 -177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.8 m-85 -65.43 -34.56 78.57 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 115.021 -0.99 . . . . 0.0 111.883 179.382 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.43 -31.38 72.09 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.384 0.674 . . . . 0.0 111.987 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -79.26 -19.37 50.77 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.003 0.921 . . . . 0.0 110.668 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -103.76 -9.11 19.32 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.633 0.773 . . . . 0.0 111.821 -170.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.3 10.91 16.62 Favored Glycine 0 C--N 1.346 1.087 0 N-CA-C 114.254 0.462 . . . . 0.0 114.254 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 91.2 m-85 -99.72 140.53 33.79 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.433 0.693 . . . . 0.0 110.037 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -101.13 173.8 6.3 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.518 1.127 . . . . 0.0 109.874 -178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -59.91 -32.34 70.66 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.992 0.917 . . . . 0.0 112.222 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 96.3 p -74.7 -5.08 41.22 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.223 1.009 . . . . 0.0 112.792 178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -97.11 -18.55 19.26 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 123.534 0.734 . . . . 0.0 110.809 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.9 t -111.99 121.23 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 122.705 0.402 . . . . 0.0 110.021 -171.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.6 m -124.44 121.16 34.11 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.303 0.641 . . . . 0.0 109.807 176.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -90.6 132.97 35.43 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.821 0.448 . . . . 0.0 110.383 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -134.76 91.13 2.73 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.355 1.062 . . . . 0.0 108.959 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.94 -122.33 16.11 Favored Glycine 0 C--N 1.347 1.161 0 CA-C-N 115.495 -0.775 . . . . 0.0 113.647 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -87.57 -0.35 56.72 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.384 1.074 . . . . 0.0 110.361 -175.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 87.7 m -127.3 133.69 50.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.018 1.327 . . . . 0.0 110.517 -175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.8 p -114.36 133.15 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.6 m -110.09 120.57 42.87 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 64.9 t -120.53 126.24 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -124.31 134.48 53.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 -174.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -178.81 178.49 48.76 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 121.755 -0.259 . . . . 0.0 112.676 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -92.92 154.1 18.39 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 121.926 0.87 . . . . 0.0 112.138 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -67.23 131.03 44.96 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.785 -1.552 . . . . 0.0 107.809 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.3 tt0 -52.78 -42.38 64.98 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.968 0.907 . . . . 0.0 111.769 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 169.29 163.25 23.0 Favored Glycine 0 C--N 1.339 0.742 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.143 177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.7 t -97.93 130.37 46.78 Favored 'Isoleucine or valine' 0 C--O 1.246 0.882 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 41.7 t0 54.71 61.95 2.75 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 125.061 1.345 . . . . 0.0 110.064 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 94.7 mt -78.28 139.53 38.87 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.347 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -90.39 -22.45 21.47 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.042 0.937 . . . . 0.0 109.275 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -85.11 69.92 10.84 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -141.6 -5.98 1.03 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 177.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -86.59 65.0 8.82 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 30.8 p80 -165.76 175.51 8.71 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 108.286 -177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -61.23 136.55 58.09 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 CA--C 1.556 1.204 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.469 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.2 mmm . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 28' ' ' VAL . 99.0 p -47.05 141.12 4.42 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 -168.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -93.27 -155.29 31.83 Favored Glycine 0 C--N 1.334 0.455 0 N-CA-C 108.986 -1.645 . . . . 0.0 108.986 -168.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -95.91 163.19 13.26 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.512 0.725 . . . . 0.0 111.417 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -91.64 133.02 35.93 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.499 0.72 . . . . 0.0 109.065 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.6 p -125.03 139.89 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -104.22 132.31 50.6 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.427 0.632 . . . . 0.0 109.305 177.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 84.7 t -120.66 120.72 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 124.93 1.292 . . . . 0.0 110.084 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -103.34 120.67 41.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 99.7 t -110.19 119.29 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 119.12 30.58 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.427 HD13 HG13 ' A' ' 48' ' ' ILE . 16.4 tt -126.88 134.76 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 122.948 0.499 . . . . 0.0 111.0 -177.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 98.5 m -102.83 127.32 50.06 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.227 0.611 . . . . 0.0 109.398 173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.445 ' SG ' HG23 ' A' ' 48' ' ' ILE . 35.8 t -149.87 122.54 8.62 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.486 1.114 . . . . 0.0 110.195 -173.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.3 t30 58.03 34.86 24.69 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.506 1.122 . . . . 0.0 110.483 177.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.87 -1.47 86.33 Favored Glycine 0 C--N 1.351 1.366 0 CA-C-N 115.325 -0.852 . . . . 0.0 114.253 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.9 tptt -115.53 130.86 57.02 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.607 0.763 . . . . 0.0 109.856 -178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 99.9 m -102.26 127.05 49.39 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -116.58 128.06 55.06 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.463 1.105 . . . . 0.0 108.032 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -138.85 145.03 39.52 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.515 0.326 . . . . 0.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -153.83 139.88 18.33 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.861 0.865 . . . . 0.0 109.536 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.5 m -100.08 132.26 45.55 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.35 1.06 . . . . 0.0 109.439 175.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -119.09 146.2 45.29 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.848 0.859 . . . . 0.0 109.747 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -102.76 120.96 41.49 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.21 118.16 33.9 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -121.06 127.98 52.2 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.715 0.806 . . . . 0.0 109.555 171.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -144.24 161.29 39.3 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.208 1.003 . . . . 0.0 109.312 -170.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.448 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 85.5 t -94.79 -52.9 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 172.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 85.9 mtm180 -102.69 153.7 19.87 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 121.055 0.455 . . . . 0.0 110.582 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -59.15 -38.43 79.67 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.105 0.962 . . . . 0.0 111.247 174.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 -65.84 -33.82 76.72 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.915 0.486 . . . . 0.0 111.391 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -65.02 -38.52 91.16 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.167 0.587 . . . . 0.0 109.971 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.01 -39.96 90.69 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.358 1.063 . . . . 0.0 111.049 178.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.6 -50.19 73.94 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.718 0.807 . . . . 0.0 111.912 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -66.32 -30.22 70.58 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.815 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -64.32 -43.27 95.2 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.324 0.65 . . . . 0.0 110.631 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.36 -39.79 95.48 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 123.892 0.745 . . . . 0.0 110.579 176.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.2 -43.42 92.25 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.887 0.475 . . . . 0.0 110.818 176.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -65.92 -46.43 78.28 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 123.862 0.726 . . . . 0.0 110.688 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 43.2 t -58.35 -48.88 83.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 123.444 0.698 . . . . 0.0 111.694 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.9 mt -65.21 -41.06 94.84 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.31 0.644 . . . . 0.0 111.383 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -66.12 -39.82 90.2 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.969 0.508 . . . . 0.0 110.871 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -63.91 -47.58 79.99 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.144 0.977 . . . . 0.0 110.658 -176.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -62.97 -33.19 74.86 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 89.3 mtp -88.51 -6.55 57.53 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.53 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -54.57 -54.44 48.81 Favored Pre-proline 0 N--CA 1.483 1.221 0 CA-C-N 119.229 0.922 . . . . 0.0 111.125 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.12 -16.6 36.11 Favored 'Trans proline' 0 C--N 1.388 2.643 0 C-N-CA 121.686 1.591 . . . . 0.0 111.695 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.4 mm -77.83 -34.89 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.373 1.069 . . . . 0.0 110.47 -175.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' HA ' HD13 ' A' ' 108' ' ' LEU . 97.2 mttt -70.47 -28.79 65.26 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.467 0.707 . . . . 0.0 109.947 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -67.43 -27.34 66.98 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.264 1.026 . . . . 0.0 109.623 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -87.08 -36.94 17.86 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.831 0.452 . . . . 0.0 109.797 -170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.2 17.98 79.63 Favored Glycine 0 C--N 1.353 1.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 113.52 171.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -42.86 110.29 0.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.12 -17.59 53.59 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.478 1.111 . . . . 0.0 112.847 -174.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -149.95 136.99 19.53 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.5 m -134.94 150.02 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -113.99 124.5 52.31 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 73.5 mt -119.45 120.27 63.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 123.336 0.654 . . . . 0.0 109.406 -176.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.9 m -111.46 128.97 56.17 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.4 mp -116.89 119.72 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 123.876 0.871 . . . . 0.0 109.681 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -112.52 133.11 54.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.3 p -107.11 139.51 28.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -88.05 130.31 35.03 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -103.84 141.13 36.66 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 124.65 1.18 . . . . 0.0 108.921 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 72.6 m -65.64 -39.21 91.21 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 123.495 0.497 . . . . 0.0 111.978 -173.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -153.81 168.92 24.71 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.242 1.017 . . . . 0.0 108.93 -175.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.29 88.17 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.641 0.776 . . . . 0.0 111.683 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.52 -35.81 82.17 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.905 0.482 . . . . 0.0 110.405 176.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -66.2 -26.13 67.25 Favored 'General case' 0 C--O 1.21 -0.978 0 C-N-CA 123.339 0.655 . . . . 0.0 112.525 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -54.7 -43.94 72.98 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.209 0.913 . . . . 0.0 110.96 -171.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -67.08 -49.04 66.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.119 0.567 . . . . 0.0 111.281 -173.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -70.09 -45.47 66.91 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.369 0.668 . . . . 0.0 109.546 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -69.28 -33.31 73.0 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.564 1.145 . . . . 0.0 112.155 -179.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.22 -47.22 80.56 Favored 'General case' 0 C--N 1.352 0.712 0 CA-C-N 118.897 0.771 . . . . 0.0 109.819 178.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -63.36 -43.17 98.44 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.94 0.896 . . . . 0.0 111.716 177.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -63.15 -53.94 45.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.915 0.886 . . . . 0.0 111.894 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -70.26 -29.35 66.12 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -178.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.92 -43.0 80.99 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.582 0.353 . . . . 0.0 111.183 179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.79 -39.51 94.46 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.204 0.602 . . . . 0.0 110.724 176.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 39.7 mm -61.67 -51.96 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.96 0.904 . . . . 0.0 110.301 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.41 -42.18 83.65 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.591 0.756 . . . . 0.0 111.393 -177.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.32 -40.48 86.38 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.343 1.057 . . . . 0.0 110.61 -177.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.66 -41.3 88.41 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.747 176.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -65.07 -39.7 86.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.507 0.723 . . . . 0.0 110.482 179.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -63.14 -41.31 99.27 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.472 177.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.19 -29.33 69.58 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.557 0.743 . . . . 0.0 111.792 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -73.62 -23.21 59.86 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.047 0.939 . . . . 0.0 111.172 177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 95.6 mt -104.38 -9.05 18.75 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.192 0.597 . . . . 0.0 111.014 -172.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.16 19.92 10.24 Favored Glycine 0 N--CA 1.475 1.256 0 C-N-CA 122.965 0.317 . . . . 0.0 113.7 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -91.77 125.32 36.45 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 175.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -109.97 72.78 0.81 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.995 0.518 . . . . 0.0 110.838 -169.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 65.04 -65.23 0.15 Allowed 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 125.244 1.417 . . . . 0.0 114.153 170.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 89.7 p -64.61 -27.14 68.74 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.126 1.37 . . . . 0.0 112.478 -176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -68.16 -26.01 65.55 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.444 0.697 . . . . 0.0 110.989 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 62.5 t -99.2 118.01 45.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.992 1.317 . . . . 0.0 110.25 -172.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.7 m -119.33 120.97 38.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.047 0.539 . . . . 0.0 110.217 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 56.1 m95 -91.87 135.02 34.25 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.967 0.507 . . . . 0.0 110.451 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -145.12 90.82 2.07 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 124.65 1.18 . . . . 0.0 109.14 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.41 -125.31 11.72 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 115.336 -0.847 . . . . 0.0 113.016 179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.8 p-10 -90.06 1.47 56.31 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.422 1.089 . . . . 0.0 110.193 -175.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 91.8 m -124.57 131.36 53.48 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.157 1.383 . . . . 0.0 110.705 -177.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.3 p -117.02 127.9 74.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 C-N-CA 124.35 1.06 . . . . 0.0 108.667 176.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -110.17 122.22 47.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.1 t -120.6 129.79 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.806 1.242 . . . . 0.0 109.409 -173.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -92.11 134.51 34.78 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -136.43 177.2 19.81 Favored Glycine 0 N--CA 1.468 0.786 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 176.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -150.59 136.41 18.27 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.463 0.705 . . . . 0.0 109.604 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 49' ' ' LYS . 68.4 mt -128.58 138.36 52.18 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.52 0.728 . . . . 0.0 109.672 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -82.69 -62.23 1.66 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.766 0.826 . . . . 0.0 108.794 -178.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 166.46 111.56 0.25 Allowed Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 114.31 -1.313 . . . . 0.0 110.045 179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.5 t -98.9 128.47 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 122.973 0.509 . . . . 0.0 110.846 -176.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 60.9 t0 -77.94 79.81 4.4 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.031 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.35 83.13 7.98 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -56.86 -40.75 76.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.105 -177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -159.97 133.93 7.3 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.032 1.333 . . . . 0.0 107.94 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 -95.48 138.75 32.73 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 176.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -118.8 165.94 13.41 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.146 0.578 . . . . 0.0 109.879 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -55.28 125.06 19.13 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.968 0.907 . . . . 0.0 110.069 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -78.33 122.86 26.3 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.925 0.766 . . . . 0.0 110.097 178.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 CA--C 1.549 0.933 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.475 ' HB3' ' HB2' ' A' ' 26' ' ' TYR . 58.8 mtt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.6 p -140.07 16.67 2.45 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.778 1.231 . . . . 0.0 111.043 157.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.2 -129.78 6.38 Favored Glycine 0 C--N 1.343 0.938 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -167.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -113.77 148.58 36.27 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 123.505 0.722 . . . . 0.0 110.129 173.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HB2' ' CZ ' ' A' ' 26' ' ' TYR . 38.5 ttpt -98.9 124.36 43.78 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.201 -163.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.6 p -116.99 147.04 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 161.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -107.79 134.82 50.2 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.1 t -124.99 122.42 63.29 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 124.369 1.068 . . . . 0.0 109.662 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 63.7 tt0 -99.06 122.49 42.38 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 175.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.9 t -110.73 116.28 52.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 179.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -114.25 118.15 33.14 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -128.0 133.15 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-O 121.06 0.457 . . . . 0.0 109.932 -178.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 95.0 m -106.24 122.44 46.23 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.68 0.792 . . . . 0.0 109.276 175.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.4 t -150.71 145.34 25.74 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.863 1.265 . . . . 0.0 108.82 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.7 t30 57.23 28.63 15.41 Favored 'General case' 0 N--CA 1.504 2.27 0 C-N-CA 124.195 0.998 . . . . 0.0 111.324 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 2.41 83.14 Favored Glycine 0 C--N 1.349 1.284 0 CA-C-N 116.363 -0.38 . . . . 0.0 112.32 178.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -113.95 148.53 36.7 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 124.545 1.138 . . . . 0.0 109.566 -176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.6 m -110.57 127.38 55.19 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -117.09 120.31 37.94 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -137.89 144.67 41.46 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.497 0.665 . . . . 0.0 112.24 178.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.0 ttt180 -153.95 138.53 16.88 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 113.733 -1.576 . . . . 0.0 107.965 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 9' ' ' GLN . 99.0 m -96.32 130.49 43.41 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -115.0 145.33 42.38 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.989 0.916 . . . . 0.0 109.942 -178.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -97.77 112.62 24.45 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 173.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 39.8 mt -107.88 111.12 23.08 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.282 1.033 . . . . 0.0 108.388 -178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.475 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 3.9 m-85 -85.44 136.9 33.25 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.66 133.85 4.3 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.244 0.618 . . . . 0.0 110.063 165.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.445 ' O ' ' CG1' ' A' ' 28' ' ' VAL . 1.1 t -100.85 -9.89 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 123.917 0.887 . . . . 0.0 109.491 175.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -128.06 149.71 50.27 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -60.72 -37.68 82.56 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.258 0.551 . . . . 0.0 111.033 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.96 -35.16 80.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.089 0.956 . . . . 0.0 111.318 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.34 -35.52 81.14 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.911 0.485 . . . . 0.0 110.768 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.44 -40.41 73.77 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.284 0.634 . . . . 0.0 111.25 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -55.42 -49.8 71.44 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.675 0.79 . . . . 0.0 111.559 -168.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 25.5 pt-20 -62.46 -31.44 72.16 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.889 0.875 . . . . 0.0 112.478 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.433 ' HE2' ' HG2' ' A' ' 1' ' ' MET . 51.2 mttp -70.01 -41.27 74.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.92 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.2 mt -63.83 -38.8 92.43 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.459 0.704 . . . . 0.0 111.862 173.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -57.98 -46.77 84.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.922 0.489 . . . . 0.0 110.707 172.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -65.15 -49.12 71.09 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.545 0.528 . . . . 0.0 111.274 -178.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.5 t -62.75 -45.56 98.53 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 C-N-CA 123.207 0.603 . . . . 0.0 111.486 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 49.1 mt -64.49 -47.73 77.84 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.898 0.479 . . . . 0.0 111.333 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -60.23 -44.04 95.54 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.334 0.654 . . . . 0.0 112.237 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -66.85 -38.13 85.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.404 0.682 . . . . 0.0 111.949 177.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -64.64 -37.34 87.23 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.298 0.571 . . . . 0.0 109.496 176.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 99.1 mmm -84.04 -11.82 56.14 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.376 -0.829 . . . . 0.0 112.023 -174.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -59.74 -56.54 34.67 Favored Pre-proline 0 CA--C 1.566 1.564 0 C-N-CA 123.161 0.585 . . . . 0.0 111.729 175.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -66.55 -22.27 51.51 Favored 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 121.393 1.395 . . . . 0.0 112.271 176.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 49.8 mm -65.52 -30.54 50.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.575 0.75 . . . . 0.0 110.315 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -69.53 -41.25 76.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.457 0.703 . . . . 0.0 110.369 173.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.8 -34.55 78.15 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 123.585 0.754 . . . . 0.0 109.293 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 95.0 mt -75.98 -23.97 55.35 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 80.85 32.26 33.39 Favored Glycine 0 C--N 1.341 0.846 0 CA-C-N 115.512 -0.767 . . . . 0.0 113.282 171.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -82.1 125.88 31.37 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -83.2 -30.22 27.92 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.28 1.032 . . . . 0.0 111.087 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -143.37 134.97 26.38 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 124.467 1.107 . . . . 0.0 108.501 -178.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.2 m -137.52 160.14 34.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.974 0.909 . . . . 0.0 109.462 -176.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -111.79 123.34 50.03 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 81.8 mt -121.38 120.72 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.414 0.685 . . . . 0.0 109.665 -177.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.9 m -110.2 127.24 54.84 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 94.8 mt -120.85 131.82 71.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.094 0.557 . . . . 0.0 109.513 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -122.84 129.99 52.34 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.607 0.763 . . . . 0.0 109.556 176.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.2 p -108.49 145.47 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 123.552 0.741 . . . . 0.0 109.216 -176.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.31 124.82 29.18 Favored 'General case' 0 C--O 1.245 0.823 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -178.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -95.01 135.18 36.86 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.936 0.772 . . . . 0.0 110.142 -174.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 74.5 m -51.84 -41.57 61.9 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.851 . . . . 0.0 111.503 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -158.87 169.1 25.09 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.277 1.031 . . . . 0.0 109.545 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.62 85.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.931 0.892 . . . . 0.0 111.09 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.96 -34.9 79.52 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.479 0.712 . . . . 0.0 111.444 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -68.42 -25.12 64.87 Favored 'General case' 0 C--O 1.204 -1.323 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.493 177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -47.63 -41.72 22.72 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -170.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -65.0 -48.73 72.93 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.588 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -68.8 -37.51 79.29 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.163 -179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -67.53 -41.65 84.01 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.017 1.327 . . . . 0.0 110.319 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -46.72 85.21 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.079 0.862 . . . . 0.0 110.841 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.34 -41.24 98.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.466 1.106 . . . . 0.0 112.457 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -58.94 -53.89 53.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.412 1.485 . . . . 0.0 109.801 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -69.82 -30.9 68.52 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.359 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.73 98.63 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 123.434 0.694 . . . . 0.0 111.076 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.95 -40.46 91.34 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.388 0.675 . . . . 0.0 111.227 175.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 36.4 mm -60.38 -50.96 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.718 174.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 72.4 mt -65.24 -35.05 79.83 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.378 0.671 . . . . 0.0 110.975 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -54.44 -41.74 69.76 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.211 1.005 . . . . 0.0 110.223 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -76.72 -39.16 52.8 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.951 178.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -64.48 -50.68 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 123.31 0.644 . . . . 0.0 111.207 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -68.16 -32.59 72.96 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.238 0.615 . . . . 0.0 110.738 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.46 -28.99 69.61 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.137 0.575 . . . . 0.0 111.497 171.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -80.38 -17.14 52.76 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.542 0.737 . . . . 0.0 110.629 176.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -100.35 -8.97 22.75 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.736 0.814 . . . . 0.0 110.867 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 87.33 21.66 47.73 Favored Glycine 0 C--N 1.348 1.232 0 N-CA-C 114.521 0.569 . . . . 0.0 114.521 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -100.24 146.44 26.89 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 97.2 m-20 -77.93 141.43 39.02 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.639 0.775 . . . . 0.0 110.127 -178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -60.65 -37.55 81.89 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.902 0.881 . . . . 0.0 112.043 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.3 p -63.97 -21.14 66.36 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.081 0.552 . . . . 0.0 112.277 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -78.91 -3.35 44.35 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.083 0.553 . . . . 0.0 111.07 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.9 t -103.5 118.23 50.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 124.45 1.1 . . . . 0.0 109.625 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.3 m -125.84 130.6 51.71 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.043 0.537 . . . . 0.0 111.353 179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -101.78 131.99 47.77 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.698 0.799 . . . . 0.0 111.323 175.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -152.28 106.07 3.11 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.474 1.11 . . . . 0.0 108.616 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 75.51 46.48 14.88 Favored Glycine 0 C--N 1.352 1.467 0 O-C-N 124.019 0.824 . . . . 0.0 113.634 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 55.16 23.5 5.43 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.021 1.328 . . . . 0.0 111.687 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.1 m -131.71 135.9 47.21 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 13.8 p -112.82 132.85 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.6 m -114.87 124.83 52.73 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 174.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.97 134.57 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 124.008 0.923 . . . . 0.0 108.612 -172.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -91.38 124.62 35.7 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 173.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.29 156.53 15.59 Favored Glycine 0 C--N 1.337 0.617 0 N-CA-C 109.789 -1.325 . . . . 0.0 109.789 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -140.28 153.4 46.48 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.225 0.536 . . . . 0.0 110.506 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.7 mt -123.56 144.8 49.34 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.454 176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -90.7 -19.68 23.31 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.597 0.759 . . . . 0.0 109.383 176.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 86.17 -60.3 4.6 Favored Glycine 0 C--N 1.342 0.88 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.746 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.5 m -87.09 160.05 3.02 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 C-N-CA 123.557 0.743 . . . . 0.0 109.976 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -68.03 146.37 53.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.713 0.405 . . . . 0.0 110.546 177.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.27 -20.91 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.056 0.942 . . . . 0.0 113.372 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -90.13 -152.89 0.27 Allowed 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 118.118 0.417 . . . . 0.0 110.498 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -69.67 72.69 0.37 Allowed 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -52.7 130.0 31.26 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.135 0.493 . . . . 0.0 111.81 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -91.02 135.02 34.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -80.85 93.61 6.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 178.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -80.8 144.91 31.73 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.244 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 C--O 1.248 1.019 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 -177.352 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.586 ' O ' ' HB2' ' A' ' 2' ' ' SER . 99.2 mmm . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.823 0.345 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.586 ' HB2' ' O ' ' A' ' 1' ' ' MET . 31.9 t 170.5 166.19 0.07 Allowed 'General case' 0 C--O 1.244 0.801 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.755 164.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -86.02 -80.14 1.16 Allowed Glycine 0 C--N 1.344 1.027 0 N-CA-C 110.48 -1.048 . . . . 0.0 110.48 156.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -96.57 152.14 18.92 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.008 0.523 . . . . 0.0 110.993 178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -99.71 141.95 31.84 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -125.14 142.18 42.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 123.982 0.913 . . . . 0.0 110.372 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -105.88 133.46 50.57 Favored 'General case' 0 C--N 1.35 0.604 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 96.8 t -122.41 123.07 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.602 1.161 . . . . 0.0 108.333 -179.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -102.3 119.98 39.72 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.0 t -113.26 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -118.81 120.13 36.44 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.247 1.019 . . . . 0.0 108.433 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 18.5 tt -126.02 129.46 72.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-O 121.329 0.585 . . . . 0.0 111.15 178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.0 m -104.24 123.74 47.88 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.962 0.905 . . . . 0.0 109.246 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.3 t -139.31 140.0 37.45 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.0 t30 73.08 -70.33 0.16 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.916 1.686 . . . . 0.0 110.523 176.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.67 2.26 0.05 OUTLIER Glycine 0 N--CA 1.464 0.506 0 CA-C-N 116.486 -0.325 . . . . 0.0 112.676 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -122.57 142.02 51.07 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.078 0.951 . . . . 0.0 109.813 -174.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.6 m -101.28 127.23 47.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -116.25 117.59 30.44 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -178.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -134.16 146.65 50.38 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.032 0.444 . . . . 0.0 110.029 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -150.62 137.06 18.76 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.6 m -95.65 131.1 42.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 174.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -115.46 145.13 42.88 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.482 0.713 . . . . 0.0 109.64 -177.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -101.38 116.23 32.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 172.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -105.54 118.94 37.85 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 2' ' ' SER . 8.9 t80 -115.43 101.85 9.28 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.356 0.662 . . . . 0.0 109.215 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.433 ' N ' ' HB2' ' A' ' 2' ' ' SER . . . -140.95 136.5 32.28 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.746 0.419 . . . . 0.0 110.018 -175.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 53.5 t -71.33 -54.36 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.812 0.845 . . . . 0.0 109.75 178.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -100.54 153.57 19.27 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.089 -171.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -58.56 -42.28 87.58 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.996 0.918 . . . . 0.0 110.925 177.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -64.64 -35.09 79.89 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.779 0.832 . . . . 0.0 111.639 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -64.93 -39.61 93.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.689 0.396 . . . . 0.0 111.348 174.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.88 -40.41 91.57 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 176.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -56.75 -50.78 71.22 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.116 0.567 . . . . 0.0 111.313 -176.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -66.95 -28.26 68.14 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.322 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.79 -40.0 76.25 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.144 0.578 . . . . 0.0 111.027 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.47 -38.82 92.37 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.683 0.393 . . . . 0.0 110.094 176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -59.88 -44.3 94.28 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.757 0.423 . . . . 0.0 111.106 173.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -63.76 -46.81 83.6 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.909 0.483 . . . . 0.0 110.524 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 49.8 t -59.8 -45.91 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.482 0.713 . . . . 0.0 111.762 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.3 mt -63.94 -44.78 91.83 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.401 0.68 . . . . 0.0 111.288 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -64.45 -42.71 95.79 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.363 0.665 . . . . 0.0 112.015 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -67.47 -39.25 85.28 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.597 0.359 . . . . 0.0 111.001 179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -64.66 -36.23 83.6 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.672 0.389 . . . . 0.0 111.307 174.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 91.2 mmm -80.31 -19.8 45.76 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.971 0.508 . . . . 0.0 112.12 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -56.49 -58.95 13.72 Favored Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.576 -0.726 . . . . 0.0 111.733 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -68.69 -26.92 32.63 Favored 'Trans proline' 0 C--N 1.387 2.558 0 CA-C-N 121.164 1.451 . . . . 0.0 112.455 177.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -68.48 -34.65 66.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.412 0.685 . . . . 0.0 111.427 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HA ' HD11 ' A' ' 108' ' ' LEU . 97.8 mttt -69.88 -39.3 76.36 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.061 0.458 . . . . 0.0 110.1 178.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -61.24 -32.56 72.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.61 1.164 . . . . 0.0 111.099 174.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 92.7 mt -75.99 -42.02 49.51 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.95 129.86 4.85 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.487 -0.779 . . . . 0.0 113.298 173.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.457 ' HB2' ' HG ' ' A' ' 108' ' ' LEU . 51.9 m -160.44 164.33 32.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.32 1.048 . . . . 0.0 108.735 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -85.99 -35.99 20.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.22 160.05 43.98 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.995 0.918 . . . . 0.0 109.172 175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m -132.58 151.29 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 123.48 0.712 . . . . 0.0 109.953 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -118.58 127.81 53.96 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 84.9 mt -122.64 125.96 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.1 m -113.61 127.28 56.0 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 86.9 mt -120.66 129.57 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 -178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -121.89 132.48 54.58 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.4 p -106.15 148.96 9.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.706 0 N-CA-C 107.418 -1.327 . . . . 0.0 107.418 -177.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.62 127.49 33.79 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 -177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -102.39 143.51 32.05 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -175.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 75.4 m -66.94 -49.17 66.34 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.764 0.826 . . . . 0.0 111.762 -175.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -155.38 170.29 22.25 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -174.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.73 -35.45 80.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.969 0.908 . . . . 0.0 113.411 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -72.99 -41.51 64.24 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.738 0.415 . . . . 0.0 111.333 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -68.48 -37.82 80.47 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.365 0.666 . . . . 0.0 111.486 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -55.35 -25.9 37.78 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -172.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -67.59 -49.5 62.85 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.372 0.606 . . . . 0.0 109.867 -179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.16 -38.76 72.18 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.579 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -70.28 -37.99 74.96 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.81 80.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 117.782 0.265 . . . . 0.0 110.707 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.63 -45.16 92.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.088 0.555 . . . . 0.0 110.258 175.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -62.43 -49.43 75.49 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.002 0.921 . . . . 0.0 109.752 -178.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -68.17 -31.12 70.44 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.778 0.831 . . . . 0.0 110.72 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.13 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.017 0.527 . . . . 0.0 109.85 176.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.24 -41.28 97.05 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.215 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 32.0 mm -56.67 -51.48 65.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 124.267 1.027 . . . . 0.0 110.821 174.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 66.4 mt -67.52 -33.69 75.59 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.903 0.881 . . . . 0.0 111.737 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.81 -38.54 75.75 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.277 0.631 . . . . 0.0 111.46 177.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.32 -39.03 59.9 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 123.752 0.658 . . . . 0.0 110.746 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.93 -54.39 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.001 0.92 . . . . 0.0 111.429 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -66.79 -36.03 81.46 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 123.649 0.593 . . . . 0.0 111.356 -177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.98 -30.46 71.45 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.12 0.568 . . . . 0.0 111.439 177.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -83.88 -14.04 52.09 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.908 0.883 . . . . 0.0 111.897 178.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.2 mt -102.78 -9.49 19.94 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 122.941 0.496 . . . . 0.0 111.412 -176.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 99.89 17.95 24.02 Favored Glycine 0 C--N 1.346 1.102 0 CA-C-O 120.876 0.154 . . . . 0.0 113.374 176.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -94.04 136.55 34.21 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -84.41 142.71 29.92 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.292 0.637 . . . . 0.0 111.537 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -51.02 -44.52 61.04 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.866 0.866 . . . . 0.0 112.207 -178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.2 p -65.11 -27.72 68.94 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 0.0 112.139 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 105' ' ' GLU . 99.7 m-20 -73.64 -6.59 47.65 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.895 177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.53 118.8 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.293 1.037 . . . . 0.0 108.903 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.6 m -127.14 130.88 50.65 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.878 0.471 . . . . 0.0 110.372 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -102.8 130.15 49.7 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.423 0.689 . . . . 0.0 110.544 176.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -151.7 107.48 3.37 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.376 1.07 . . . . 0.0 109.184 177.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 74.78 51.12 8.22 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.9 0.75 . . . . 0.0 113.171 176.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 50.95 21.98 1.09 Allowed 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 126.425 1.89 . . . . 0.0 113.56 -176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 30.0 m -127.2 135.08 50.16 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.416 1.487 . . . . 0.0 107.931 -176.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 14.9 p -110.95 129.31 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 100.0 m -110.33 121.94 46.5 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -125.82 129.37 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 94' ' ' ASN . 96.3 mt-10 -113.58 145.42 41.28 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -158.74 172.07 35.53 Favored Glycine 0 C--O 1.238 0.384 0 N-CA-C 110.671 -0.972 . . . . 0.0 110.671 177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -85.31 137.47 32.94 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.7 tm? -71.54 129.99 40.12 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.962 0.905 . . . . 0.0 109.767 -179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 74.88 -67.14 0.26 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.793 1.237 . . . . 0.0 109.684 177.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -80.79 66.39 3.75 Favored Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 176.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.3 t -72.61 81.8 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-O 121.923 0.868 . . . . 0.0 111.798 -176.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -170.76 157.75 5.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.79 1.236 . . . . 0.0 108.706 178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 90.6 mt -105.94 -26.97 11.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.598 0.759 . . . . 0.0 110.008 173.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -94.85 77.32 3.63 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.618 0.767 . . . . 0.0 111.669 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.96 70.38 10.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.592 0.757 . . . . 0.0 109.705 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -76.56 135.24 39.26 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.117 178.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -138.06 65.16 1.48 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.109 0.963 . . . . 0.0 108.554 -179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -96.44 129.11 43.87 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.616 0.766 . . . . 0.0 109.852 -178.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -59.61 121.32 11.3 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 64.9 m170 . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 124.317 1.047 . . . . 0.0 109.541 -179.793 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mtp . . . . . 0 CA--C 1.551 1.004 0 CA-C-O 121.79 0.805 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.9 t -110.68 -65.01 1.2 Allowed 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.088 -172.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 174.94 115.03 0.39 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -136.35 144.34 44.56 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.274 0.559 . . . . 0.0 111.002 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -106.73 121.56 44.6 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 177.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.8 p -117.33 142.29 32.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 169.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HG2' ' HG2' ' A' ' 24' ' ' GLN . 91.7 mt-10 -102.61 135.1 44.85 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 178.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.3 t -117.7 119.68 62.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 124.645 1.178 . . . . 0.0 109.33 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -103.19 116.23 32.08 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 94.8 t -113.14 122.69 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -121.06 119.99 34.05 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.016 0.926 . . . . 0.0 108.986 178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.1 tt -128.3 134.33 65.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 CA-C-O 121.257 0.551 . . . . 0.0 110.934 -176.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 99.9 m -106.8 131.39 53.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 48' ' ' ILE . 10.0 t -155.84 124.43 5.94 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.272 1.029 . . . . 0.0 109.748 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 78.39 -64.89 0.25 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 125.222 1.409 . . . . 0.0 109.443 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 174.98 14.94 0.02 OUTLIER Glycine 0 C--N 1.338 0.663 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 174.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -119.79 139.51 52.22 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.732 1.213 . . . . 0.0 109.338 172.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.4 m -109.36 129.86 55.52 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -117.85 127.23 53.67 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -176.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 25.0 pt-20 -136.86 143.07 42.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-O 121.262 0.553 . . . . 0.0 110.122 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -154.41 135.47 13.88 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.567 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 98.0 m -101.47 131.64 47.49 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.933 0.893 . . . . 0.0 108.986 174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -117.81 146.91 43.51 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.119 0.968 . . . . 0.0 110.188 -178.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.417 ' HG2' ' HG2' ' A' ' 7' ' ' GLU . 85.3 mt-30 -101.94 118.63 37.31 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 172.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 66.5 mt -115.19 102.36 9.82 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.135 0.974 . . . . 0.0 109.258 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -95.99 124.16 39.89 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.224 0.61 . . . . 0.0 109.863 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.44 151.8 46.52 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.269 0.628 . . . . 0.0 110.514 -173.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.86 -41.95 11.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.445 0.698 . . . . 0.0 109.182 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -113.81 150.69 33.13 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.83 -176.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -59.7 -39.6 85.15 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.819 178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 54.1 tp10 -63.81 -34.87 78.88 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.023 0.929 . . . . 0.0 111.784 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -65.09 -41.31 95.13 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.436 0.294 . . . . 0.0 110.341 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.44 -39.97 89.22 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.614 0.765 . . . . 0.0 110.929 177.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -57.26 -51.12 70.64 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.695 0.798 . . . . 0.0 112.034 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.8 pt-20 -64.73 -31.57 72.85 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -65.32 -42.06 93.37 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.715 0.806 . . . . 0.0 110.48 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.6 mt -61.34 -41.65 97.4 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 124.025 0.828 . . . . 0.0 109.691 177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -59.19 -44.79 92.22 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 124.115 0.885 . . . . 0.0 112.058 175.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -63.3 -45.35 91.79 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.954 0.501 . . . . 0.0 110.143 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.45 -49.07 84.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.481 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.5 mt -65.0 -43.01 93.96 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.412 0.685 . . . . 0.0 110.993 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -67.19 -37.59 83.93 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 122.418 0.287 . . . . 0.0 111.107 176.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -61.84 -42.85 99.54 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.616 . . . . 0.0 111.432 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -67.52 -17.29 64.61 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.366 0.666 . . . . 0.0 111.51 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 98.5 mmm -89.49 -9.47 49.91 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 177.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -55.73 -56.08 33.76 Favored Pre-proline 0 CA--C 1.568 1.662 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.577 -177.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.3 -19.71 25.28 Favored 'Trans proline' 0 C--N 1.398 3.176 0 C-N-CA 122.363 2.042 . . . . 0.0 112.802 177.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.477 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.7 mm -66.93 -34.39 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 124.162 0.985 . . . . 0.0 110.099 -170.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.23 -39.83 78.29 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.618 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -65.03 -31.01 72.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.049 0.54 . . . . 0.0 111.34 174.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.418 ' HB2' ' SG ' ' A' ' 14' ' ' CYS . 95.6 mt -74.64 -29.43 61.27 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -176.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.26 10.9 81.67 Favored Glycine 0 C--N 1.343 0.947 0 CA-C-N 115.393 -0.821 . . . . 0.0 114.664 166.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.7 p -62.36 126.48 27.48 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.649 0.78 . . . . 0.0 110.11 173.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -68.59 -51.2 45.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.178 0.591 . . . . 0.0 110.446 177.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -111.46 143.96 41.45 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.144 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.1 m -134.57 153.11 34.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 C-N-CA 123.581 0.752 . . . . 0.0 109.467 -176.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -119.34 123.63 44.64 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -121.68 133.98 66.43 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -174.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 40.8 t -117.08 126.44 52.84 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 174.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 4.2 mp -118.89 118.1 56.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -111.61 135.62 51.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.2 p -104.18 138.3 29.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 N-CA-C 106.941 -1.504 . . . . 0.0 106.941 -177.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -86.95 134.05 33.54 Favored 'General case' 0 N--CA 1.478 0.925 0 CA-C-O 121.123 0.487 . . . . 0.0 109.842 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -110.68 132.56 54.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.486 1.114 . . . . 0.0 109.352 177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 81.7 p -90.49 -46.51 8.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.689 0.795 . . . . 0.0 111.525 -174.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -95.07 -107.89 0.14 Allowed 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 118.664 -0.684 . . . . 0.0 109.954 -174.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 175.01 -65.02 0.01 OUTLIER 'General case' 0 C--N 1.362 1.119 0 C-N-CA 125.326 1.45 . . . . 0.0 107.883 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.12 -52.2 64.82 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.476 -173.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -69.78 -33.3 72.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.478 177.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 73' ' ' GLU . 51.6 mm-40 -61.54 -25.36 67.25 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.23 0.612 . . . . 0.0 112.144 -174.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.5 -44.09 93.17 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.291 0.567 . . . . 0.0 110.118 174.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -70.48 -40.27 73.74 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.748 1.219 . . . . 0.0 110.974 175.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HA ' ' A' ' 70' ' ' GLU . 75.2 mm-40 -65.2 -33.78 76.81 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.53 94.85 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.59 0.356 . . . . 0.0 110.259 174.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -60.18 -41.35 92.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.636 0.774 . . . . 0.0 110.212 175.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -64.81 -48.7 73.44 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.688 0.795 . . . . 0.0 110.442 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -72.19 -30.76 65.27 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.553 -175.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.472 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -58.18 -43.26 87.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.228 0.611 . . . . 0.0 110.48 177.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.29 96.59 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.232 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.9 mm -63.35 -50.03 80.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 123.839 0.856 . . . . 0.0 110.904 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.3 mt -67.17 -43.53 82.0 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 123.12 0.568 . . . . 0.0 110.178 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -61.9 -38.01 86.76 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 124.036 0.934 . . . . 0.0 111.474 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -67.65 -41.42 83.84 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.293 0.637 . . . . 0.0 111.223 174.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.7 t -64.02 -41.42 92.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.034 0.534 . . . . 0.0 110.141 178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -60.11 -45.11 94.07 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 124.089 0.868 . . . . 0.0 110.242 178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.15 74.68 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.531 0.732 . . . . 0.0 111.318 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -74.02 -22.48 59.55 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.064 0.946 . . . . 0.0 110.835 -179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -100.75 -10.25 20.99 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.885 0.874 . . . . 0.0 110.477 -175.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.96 22.67 19.79 Favored Glycine 0 N--CA 1.479 1.516 0 N-CA-C 114.063 0.385 . . . . 0.0 114.063 175.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -86.85 137.25 32.56 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.424 0.69 . . . . 0.0 109.489 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -79.11 123.88 27.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.587 0.755 . . . . 0.0 111.781 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -49.18 -36.09 18.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.927 1.291 . . . . 0.0 110.998 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -60.18 -37.55 80.52 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.699 1.2 . . . . 0.0 113.5 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -85.38 6.68 25.51 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.745 0.418 . . . . 0.0 111.632 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 75.0 t -105.87 117.3 51.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 177.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -119.38 119.52 34.2 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.474 0.71 . . . . 0.0 110.41 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.472 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 51.1 m95 -92.79 133.97 35.52 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.29 0.636 . . . . 0.0 111.685 176.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -144.69 93.11 2.37 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.0 -1.481 . . . . 0.0 107.0 172.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.01 -118.83 12.93 Favored Glycine 0 C--N 1.362 2.008 0 CA-C-N 114.119 -1.4 . . . . 0.0 114.769 178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -84.64 0.64 49.51 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.06 1.744 . . . . 0.0 112.82 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 75.7 m -129.43 131.0 46.65 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.715 0.806 . . . . 0.0 110.501 -174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 9.0 p -117.6 133.04 65.63 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.503 0.668 . . . . 0.0 110.327 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.7 m -107.13 117.87 35.2 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.849 1.26 . . . . 0.0 108.983 -179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.5 t -118.89 126.92 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.429 0.692 . . . . 0.0 109.527 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -103.28 129.74 50.35 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -139.4 179.28 18.88 Favored Glycine 0 C--N 1.34 0.774 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -139.79 141.07 36.78 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.807 0.843 . . . . 0.0 110.138 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 65.2 tp -72.66 123.53 23.44 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.934 0.894 . . . . 0.0 108.815 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 62.01 9.99 3.38 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 126.114 1.765 . . . . 0.0 114.445 -166.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -91.05 -33.47 8.18 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 170.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -78.06 -155.03 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.341 0 C-N-CA 125.1 1.36 . . . . 0.0 110.241 171.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -57.63 116.57 3.48 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.27 0.628 . . . . 0.0 111.354 178.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.05 145.42 54.47 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 123.776 0.831 . . . . 0.0 109.388 -176.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -111.48 165.89 11.6 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.03 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -68.06 -23.29 64.95 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.5 0.72 . . . . 0.0 110.59 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 64.3 t-80 -100.42 131.3 46.42 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 64.2 t-80 -75.11 117.61 17.13 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 124.053 0.845 . . . . 0.0 111.473 176.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -110.45 172.05 7.09 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 -177.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -58.85 138.13 57.44 Favored 'General case' 0 CA--C 1.558 1.275 0 CA-C-N 118.393 0.542 . . . . 0.0 111.104 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 CA--C 1.553 1.075 0 C-N-CA 125.147 1.379 . . . . 0.0 108.445 179.341 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 26' ' ' TYR . 74.7 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 119.977 -0.059 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.594 ' HB3' ' HA ' ' A' ' 27' ' ' ALA . 39.8 t -166.72 -95.94 0.01 OUTLIER 'General case' 0 C--O 1.246 0.898 0 C-N-CA 123.469 0.708 . . . . 0.0 110.695 -165.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.474 ' O ' ' CD2' ' A' ' 26' ' ' TYR . . . -119.84 -133.9 4.67 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -42.33 143.04 0.68 Allowed 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.536 1.134 . . . . 0.0 110.199 -156.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 26' ' ' TYR . 36.4 ttpt -98.88 135.29 40.53 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 -166.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.5 p -142.7 144.88 23.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -106.08 139.18 41.01 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 175.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 93.4 t -120.78 117.43 53.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 C-N-CA 125.079 1.352 . . . . 0.0 108.57 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -104.69 117.66 34.65 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 -178.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 83.6 t -115.2 119.83 62.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -173.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.438 ' HG3' ' HB2' ' A' ' 20' ' ' GLU . 79.9 tttt -119.01 119.99 35.91 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 174.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.2 tt -126.29 139.94 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 122.973 0.509 . . . . 0.0 110.291 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 96.1 m -107.28 126.07 51.97 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.9 t -151.42 134.61 15.97 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.083 0.953 . . . . 0.0 108.981 179.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.9 t30 61.4 31.24 19.17 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.226 1.41 . . . . 0.0 110.982 178.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.59 2.61 64.46 Favored Glycine 0 C--N 1.352 1.45 0 CA-C-N 115.577 -0.738 . . . . 0.0 113.821 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -105.67 154.13 20.86 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.994 0.918 . . . . 0.0 110.01 -176.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 98.5 m -101.68 120.36 40.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.25 0.62 . . . . 0.0 109.388 177.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 -115.45 111.24 20.48 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.438 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 88.5 tt0 -133.93 136.22 44.09 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -173.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -152.84 137.39 16.81 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.189 -177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 97.1 m -96.95 129.2 44.45 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.573 0.749 . . . . 0.0 109.879 173.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -114.26 137.84 51.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.745 0.818 . . . . 0.0 109.38 -175.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -96.47 117.56 31.15 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.0 mt -111.51 131.7 55.04 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.884 0.874 . . . . 0.0 109.344 174.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.493 ' O ' ' N ' ' A' ' 2' ' ' SER . 13.9 t80 -129.93 99.68 5.19 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -172.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.594 ' HA ' ' HB3' ' A' ' 2' ' ' SER . . . -142.71 133.34 25.21 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.228 0.611 . . . . 0.0 109.45 -167.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.4 t -68.01 -51.95 43.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 O-C-N 124.154 0.909 . . . . 0.0 109.225 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -101.63 152.51 20.73 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.921 0.867 . . . . 0.0 111.596 -176.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -60.78 -39.2 87.92 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.556 -1.657 . . . . 0.0 111.062 175.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -66.23 -36.51 83.21 Favored 'General case' 0 C--N 1.353 0.756 0 C-N-CA 124.203 1.001 . . . . 0.0 111.581 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -64.89 -36.99 86.16 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.903 175.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.467 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.4 OUTLIER -68.23 -38.05 81.48 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 123.869 0.868 . . . . 0.0 110.813 176.075 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -56.07 -51.53 67.52 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 122.902 0.481 . . . . 0.0 111.616 -176.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -63.65 -33.02 74.7 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.782 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -68.08 -37.92 81.78 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.261 0.624 . . . . 0.0 110.476 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.35 -41.15 96.59 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 123.983 0.802 . . . . 0.0 110.466 173.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -59.98 -43.48 95.1 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 123.045 0.538 . . . . 0.0 110.934 173.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -62.05 -47.65 83.76 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.016 0.526 . . . . 0.0 110.008 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -62.13 -45.04 99.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.083 1.353 . . . . 0.0 112.019 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' MET . 31.6 mt -62.58 -48.5 79.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 122.856 0.463 . . . . 0.0 110.577 175.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -61.37 -44.69 96.73 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.786 0.434 . . . . 0.0 111.621 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -65.11 -40.77 94.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 122.587 0.355 . . . . 0.0 110.64 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -64.08 -41.93 97.13 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.248 0.619 . . . . 0.0 111.075 177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.432 ' SD ' HD11 ' A' ' 58' ' ' ILE . 96.5 mmm -88.73 -14.52 37.01 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 118.74 -0.647 . . . . 0.0 112.607 -172.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -54.67 -54.33 50.34 Favored Pre-proline 0 CA--C 1.564 1.489 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.542 176.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.25 -23.37 33.2 Favored 'Trans proline' 0 C--N 1.394 2.97 0 C-N-CA 121.955 1.77 . . . . 0.0 111.952 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 45.6 mm -69.59 -30.28 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.888 0.875 . . . . 0.0 110.813 -178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -41.7 74.21 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 173.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.21 -33.4 75.41 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.33 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.8 mt -74.79 -25.76 59.27 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.25 46.53 8.09 Favored Glycine 0 C--N 1.352 1.46 0 O-C-N 124.265 0.978 . . . . 0.0 112.965 168.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 75.3 m -89.87 120.48 31.14 Favored 'General case' 0 C--O 1.241 0.63 0 O-C-N 124.333 0.667 . . . . 0.0 109.915 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 112' ' ' ASP . 87.9 tttt -72.36 -58.87 3.05 Favored 'General case' 0 C--O 1.214 -0.788 0 O-C-N 124.726 1.266 . . . . 0.0 110.492 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 80.2 ttt180 -102.71 132.52 48.79 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 24.8 m -130.6 150.2 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.569 0.747 . . . . 0.0 109.581 -176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttm180 -119.47 124.06 45.55 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 86.1 mt -121.39 124.41 71.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 m -112.2 126.06 54.81 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 175.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.0 mt -119.09 123.47 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.488 0.715 . . . . 0.0 109.945 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -112.57 129.99 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 174.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -108.24 139.72 29.44 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.99 130.32 38.61 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 -175.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -118.17 139.24 51.56 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.762 1.225 . . . . 0.0 109.417 171.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.9 m -85.18 -51.17 6.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.562 0.745 . . . . 0.0 111.23 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -82.79 116.5 22.16 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.222 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.86 -31.66 72.73 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.637 0.775 . . . . 0.0 112.842 -176.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.68 -50.47 13.62 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.971 0.508 . . . . 0.0 110.415 177.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.1 -30.82 68.13 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.005 0.522 . . . . 0.0 112.044 -172.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -49.82 -29.91 8.82 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 124.925 1.391 . . . . 0.0 114.726 -170.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -64.55 -47.62 78.1 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.048 0.939 . . . . 0.0 110.671 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -73.29 -38.36 65.91 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.052 0.541 . . . . 0.0 110.31 178.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -67.48 -33.32 74.86 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 124.288 1.035 . . . . 0.0 111.576 -177.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.49 -46.28 89.18 Favored 'General case' 0 C--N 1.357 0.915 0 C-N-CA 123.453 0.701 . . . . 0.0 111.694 173.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.99 -38.47 91.21 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.946 0.498 . . . . 0.0 111.176 174.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -64.12 -47.42 80.06 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.412 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.411 ' O ' ' HB ' ' A' ' 80' ' ' ILE . 20.2 t80 -70.6 -31.24 68.15 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.78 0.832 . . . . 0.0 109.585 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.53 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -56.48 -42.3 78.05 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.603 0.761 . . . . 0.0 109.752 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.78 91.83 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.917 0.761 . . . . 0.0 110.302 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 77' ' ' PHE . 41.9 mm -62.88 -50.53 79.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.338 1.055 . . . . 0.0 111.229 -177.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 32.9 mt -66.32 -44.11 84.31 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.849 0.86 . . . . 0.0 110.029 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -61.96 -39.7 93.03 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 124.001 0.813 . . . . 0.0 109.815 -176.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -68.36 -40.82 81.34 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 122.877 0.471 . . . . 0.0 111.107 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 46.5 t -64.67 -43.62 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.451 0.7 . . . . 0.0 110.897 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -63.39 -41.46 98.76 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.83 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.82 -32.17 73.55 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.59 0.756 . . . . 0.0 111.735 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -76.41 -21.61 55.76 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.599 0.76 . . . . 0.0 111.378 178.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.05 -6.54 26.26 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.531 0.732 . . . . 0.0 111.067 -174.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 101.53 20.54 13.08 Favored Glycine 0 C--N 1.351 1.365 0 N-CA-C 114.471 0.548 . . . . 0.0 114.471 174.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -99.26 146.98 25.63 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 176.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 44.1 p30 -89.55 175.31 7.34 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.12 0.568 . . . . 0.0 111.358 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -84.82 -34.61 22.67 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.298 1.039 . . . . 0.0 111.634 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.9 m -54.55 -41.93 70.36 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.996 0.918 . . . . 0.0 112.814 -176.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -93.25 18.99 8.64 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -178.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 98.6 t -106.57 119.03 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 174.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.5 m -118.19 114.72 23.46 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.222 0.609 . . . . 0.0 109.644 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.53 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 49.9 m95 -92.34 133.26 36.02 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.674 0.75 . . . . 0.0 111.861 176.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -140.05 90.1 2.35 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 126.254 1.821 . . . . 0.0 106.589 175.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.48 -119.17 13.3 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.193 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -89.88 3.58 52.54 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.761 0.824 . . . . 0.0 110.902 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 86.4 m -125.79 130.03 50.61 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.684 0.794 . . . . 0.0 109.988 -173.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.5 p -121.54 135.03 62.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 N-CA-C 107.91 -1.145 . . . . 0.0 107.91 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.4 m -110.75 121.43 45.33 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 174.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 84.7 t -124.89 127.31 72.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 C-N-CA 124.774 1.23 . . . . 0.0 108.487 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.2 mt-10 -114.81 146.07 41.43 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 175.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -169.95 171.78 43.53 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.157 176.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 47.2 tt0 -84.82 134.94 34.29 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.412 HD22 ' HE3' ' A' ' 45' ' ' MET . 35.8 tp -105.42 122.87 46.88 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 48.21 -70.51 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 126.514 1.926 . . . . 0.0 114.161 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 134.16 6.85 2.37 Favored Glycine 0 C--N 1.344 1.004 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 -173.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 86.4 t -79.02 131.19 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 122.225 1.012 . . . . 0.0 111.937 167.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 54' ' ' LYS . 68.4 t0 -138.39 98.18 3.54 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 114.326 -1.306 . . . . 0.0 107.928 -176.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -87.67 86.71 7.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.163 0.985 . . . . 0.0 109.813 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -76.84 -36.65 56.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.023 0.929 . . . . 0.0 112.288 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -128.66 -35.47 1.91 Allowed 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.254 0.621 . . . . 0.0 109.824 -176.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -85.45 66.05 9.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.52 0.728 . . . . 0.0 110.023 178.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -74.91 139.95 43.44 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.606 1.162 . . . . 0.0 112.876 -173.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -64.58 135.31 55.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.366 0.667 . . . . 0.0 110.407 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 34.0 p80 -66.81 166.43 13.26 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.945 0.898 . . . . 0.0 110.551 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 122.882 0.473 . . . . 0.0 110.562 179.768 . . . . . . . . 0 0 . 1 stop_ save_